10,20-bis(4-methylphenyl)-15-[(E)-3-oxidanylideneprop-1-enyl]-23,24-dihydroporphyrin-5-carbaldehyde

Systemtic Name: 10,20-bis(4-methylphenyl)-15-[(E)-3-oxidanylideneprop-1-enyl]-23,24-dihydroporphyrin-5-carbaldehyde Openeye Name: 15-[(E)-3-oxoprop-1-enyl]-10,20-bis(p-tolyl)-23,24-dihydroporphyrin-5-carbaldehyde CAS Name: 10,20-bis(4-methylphenyl)-15-[(E)-3-oxoprop-1-enyl]-23,24-dihydroporphyrin-5-carboxaldehyde IUPAC Name: 10,20-bis(4-methylphenyl)-15-[(E)-3-oxoprop-1-enyl]-23,24-dihydroporphyrin-5-carbaldehyde Traditional Name: 15-[(E)-3-ketoprop-1-enyl]-10,20-bis(p-tolyl)-23,24-dihydroporphine-5-carbaldehyde Formula: C38H28N4O2 MolecularWeight: 572.65452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C=O)C7=CC=C(C=C7)C)C=CC=O)N3

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C=O)C7=CC=C(C=C7)C)/C=C/C=O)N3

InChI

InChI=1S/C38H28N4O2/c1-23-5-9-25(10-6-23)37-33-17-13-29(39-33)27(4-3-21-43)30-14-18-34(40-30)38(26-11-7-24(2)8-12-26)36-20-16-32(42-36)28(22-44)31-15-19-35(37)41-31/h3-22,39-40H,1-2H3/b4-3+,29-27?,30-27?,31-28?,32-28?,37-33?,37-35?,38-34?,38-36?