methyl 3-(13,18-diethyl-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoate

Systemtic Name: methyl 3-(13,18-diethyl-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoate Openeye Name: methyl 3-(13,18-diethyl-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoate CAS Name: 3-(13,18-diethyl-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(13,18-diethyl-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoate Traditional Name: 3-(13,18-diethyl-3,7,12,17-tetramethyl-22,23-dihydroporphin-2-yl)propionic acid methyl ester Formula: C32H36N4O2 MolecularWeight: 508.65384

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C=C(C(=CC5=NC(=CC1=N2)C(=C5C)CCC(=O)OC)N4)C)C)CC)C

Isomeric SMILES

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C=C(C(=CC5=NC(=CC1=N2)C(=C5C)CCC(=O)OC)N4)C)C)CC)C

InChI

InChI=1S/C32H36N4O2/c1-8-22-18(4)26-13-21-12-17(3)25(33-21)14-27-20(6)24(10-11-32(37)38-7)31(36-27)16-30-23(9-2)19(5)28(35-30)15-29(22)34-26/h12-16,33-34H,8-11H2,1-7H3