3,3,7,8,12,13,17,18-octaethyl-22,24-dihydroporphyrin-2-one

Systemtic Name: 3,3,7,8,12,13,17,18-octaethyl-22,24-dihydroporphyrin-2-one Openeye Name: 3,3,7,8,12,13,17,18-octaethyl-22,24-dihydroporphyrin-2-one CAS Name: 3,3,7,8,12,13,17,18-octaethyl-22,24-dihydroporphyrin-2-one IUPAC Name: 3,3,7,8,12,13,17,18-octaethyl-22,24-dihydroporphyrin-2-one Traditional Name: 3,3,7,8,12,13,17,18-octaethyl-22,24-dihydroporphin-2-one Formula: C36H46N4O MolecularWeight: 550.77664

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=N5)C=C1N2)CC)CC)CC)CC)C(C3=O)(CC)CC)CC

Isomeric SMILES

CCC1=C(C2=CC3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=N5)C=C1N2)CC)CC)CC)CC)C(C3=O)(CC)CC)CC

InChI

InChI=1S/C36H46N4O/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/h17-20,38-39H,9-16H2,1-8H3