12-ethenyl-3,3,7,8,13,17,18-heptaethyl-22,23-dihydroporphyrin-2-one

Systemtic Name: 12-ethenyl-3,3,7,8,13,17,18-heptaethyl-22,23-dihydroporphyrin-2-one Openeye Name: 3,3,7,8,13,17,18-heptaethyl-12-vinyl-22,23-dihydroporphyrin-2-one CAS Name: 12-ethenyl-3,3,7,8,13,17,18-heptaethyl-22,23-dihydroporphyrin-2-one IUPAC Name: 12-ethenyl-3,3,7,8,13,17,18-heptaethyl-22,23-dihydroporphyrin-2-one Traditional Name: 3,3,7,8,13,17,18-heptaethyl-12-vinyl-22,23-dihydroporphin-2-one Formula: C36H44N4O MolecularWeight: 548.76076

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(C(=O)C(=N4)C=C5C(=C(C(=N5)C=C1N2)CC)CC)(CC)CC)CC)CC)C=C

Isomeric SMILES

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(C(=O)C(=N4)C=C5C(=C(C(=N5)C=C1N2)CC)CC)(CC)CC)CC)CC)C=C

InChI

InChI=1S/C36H44N4O/c1-9-21-22(10-2)28-18-30-25(13-5)26(14-6)32(39-30)20-34-36(15-7,16-8)35(41)33(40-34)19-31-24(12-4)23(11-3)29(38-31)17-27(21)37-28/h10,17-20,37,39H,2,9,11-16H2,1,3-8H3