methyl 4-[7,12,17-tris(4-methoxy-4-oxidanylidene-butyl)-3,8,13,18-tetrakis(2-methoxy-2-oxidanylidene-ethyl)-5,10,15,20,21,22,23,24-octahydroporphyrin-2-yl]butanoate

Systemtic Name: methyl 4-[7,12,17-tris(4-methoxy-4-oxidanylidene-butyl)-3,8,13,18-tetrakis(2-methoxy-2-oxidanylidene-ethyl)-5,10,15,20,21,22,23,24-octahydroporphyrin-2-yl]butanoate Openeye Name: methyl 4-[7,12,17-tris(4-methoxy-4-oxo-butyl)-3,8,13,18-tetrakis(2-methoxy-2-oxo-ethyl)-5,10,15,20,21,22,23,24-octahydroporphyrin-2-yl]butanoate CAS Name: 4-[7,12,17-tris(4-methoxy-4-oxobutyl)-3,8,13,18-tetrakis(2-methoxy-2-oxoethyl)-5,10,15,20,21,22,23,24-octahydroporphyrin-2-yl]butanoic acid methyl ester IUPAC Name: methyl 4-[7,12,17-tris(4-methoxy-4-oxobutyl)-3,8,13,18-tetrakis(2-methoxy-2-oxoethyl)-5,10,15,20,21,22,23,24-octahydroporphyrin-2-yl]butanoate Traditional Name: 4-[7,12,17-tris(4-keto-4-methoxy-butyl)-3,8,13,18-tetrakis(2-keto-2-methoxy-ethyl)-5,10,15,20,21,22,23,24-octahydroporphin-2-yl]butyric acid methyl ester Formula: C52H68N4O16 MolecularWeight: 1005.11352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=C2CC3=C(C(=C(N3)CC4=C(C(=C(N4)CC5=C(C(=C(N5)CC(=C1CC(=O)OC)N2)CCCC(=O)OC)CC(=O)OC)CCCC(=O)OC)CC(=O)OC)CCCC(=O)OC)CC(=O)OC

Isomeric SMILES

COC(=O)CCCC1=C2CC3=C(C(=C(N3)CC4=C(C(=C(N4)CC5=C(C(=C(N5)CC(=C1CC(=O)OC)N2)CCCC(=O)OC)CC(=O)OC)CCCC(=O)OC)CC(=O)OC)CCCC(=O)OC)CC(=O)OC

InChI

InChI=1S/C52H68N4O16/c1-65-45(57)17-9-13-29-33(21-49(61)69-5)41-26-38-31(15-11-19-47(59)67-3)35(23-51(63)71-7)43(55-38)28-40-32(16-12-20-48(60)68-4)36(24-52(64)72-8)44(56-40)27-39-30(14-10-18-46(58)66-2)34(22-50(62)70-6)42(54-39)25-37(29)53-41/h53-56H,9-28H2,1-8H3