3,3,7,8,12,13,17,17-octaethyl-2,18-dimethyl-2,18,22,23-tetrahydroporphyrin

Systemtic Name: 3,3,7,8,12,13,17,17-octaethyl-2,18-dimethyl-2,18,22,23-tetrahydroporphyrin Openeye Name: 3,3,7,8,12,13,17,17-octaethyl-2,18-dimethyl-2,18,22,23-tetrahydroporphyrin CAS Name: 3,3,7,8,12,13,17,17-octaethyl-2,18-dimethyl-2,18,22,23-tetrahydroporphyrin IUPAC Name: 3,3,7,8,12,13,17,17-octaethyl-2,18-dimethyl-2,18,22,23-tetrahydroporphyrin Traditional Name: 3,3,7,8,12,13,17,17-octaethyl-2,18-dimethyl-2,18,22,23-tetrahydroporphine Formula: C38H54N4 MolecularWeight: 566.86216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)CC)C(C4C)(CC)CC)C(C3(CC)CC)C)CC

Isomeric SMILES

CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)CC)C(C4C)(CC)CC)C(C3(CC)CC)C)CC

InChI

InChI=1S/C38H54N4/c1-11-25-27(13-3)33-21-35-37(15-5,16-6)23(9)29(41-35)19-30-24(10)38(17-7,18-8)36(42-30)22-34-28(14-4)26(12-2)32(40-34)20-31(25)39-33/h19-24,39-40H,11-18H2,1-10H3