[2-methoxy-4-(4-oxidanylidene-2-phenyl-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-5-yl)phenyl] 4-methylbenzoate

Systemtic Name: [2-methoxy-4-(4-oxidanylidene-2-phenyl-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-5-yl)phenyl] 4-methylbenzoate Openeye Name: [2-methoxy-4-(4-oxo-2-phenyl-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-5-yl)phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-methoxy-4-(4-oxo-2-phenyl-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-5-yl)phenyl] ester IUPAC Name: [2-methoxy-4-(4-oxo-2-phenyl-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-5-yl)phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-(4-keto-2-phenyl-2,3,5,6-tetrahydro-1H-benzo[a]phenanthridin-5-yl)-2-methoxy-phenyl] ester Formula: C38H31NO4 MolecularWeight: 565.65704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C3C4=C(CC(CC4=O)C5=CC=CC=C5)C6=C(N3)C=CC7=CC=CC=C76)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C3C4=C(CC(CC4=O)C5=CC=CC=C5)C6=C(N3)C=CC7=CC=CC=C76)OC

InChI

InChI=1S/C38H31NO4/c1-23-12-14-26(15-13-23)38(41)43-33-19-17-27(22-34(33)42-2)37-36-30(20-28(21-32(36)40)24-8-4-3-5-9-24)35-29-11-7-6-10-25(29)16-18-31(35)39-37/h3-19,22,28,37,39H,20-21H2,1-2H3