[4-[[(4-butylphenyl)amino]methylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl] 4-heptoxybenzoate

Systemtic Name: [4-[[(4-butylphenyl)amino]methylidene]-3-oxidanylidene-cyclohexa-1,5-dien-1-yl] 4-heptoxybenzoate Openeye Name: [4-[(4-butylanilino)methylene]-3-oxo-cyclohexa-1,5-dien-1-yl] 4-heptoxybenzoate CAS Name: 4-heptoxybenzoic acid [4-[(4-butylanilino)methylidene]-3-oxo-1-cyclohexa-1,5-dienyl] ester IUPAC Name: [4-[(4-butylanilino)methylidene]-3-oxocyclohexa-1,5-dien-1-yl] 4-heptoxybenzoate Traditional Name: 4-heptoxybenzoic acid [4-[(4-butylanilino)methylene]-3-keto-cyclohexa-1,5-dien-1-yl] ester Formula: C31H37NO4 MolecularWeight: 487.62978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=O)C(=CNC3=CC=C(C=C3)CCCC)C=C2

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=O)C(=CNC3=CC=C(C=C3)CCCC)C=C2

InChI

InChI=1S/C31H37NO4/c1-3-5-7-8-9-21-35-28-18-13-25(14-19-28)31(34)36-29-20-15-26(30(33)22-29)23-32-27-16-11-24(12-17-27)10-6-4-2/h11-20,22-23,32H,3-10,21H2,1-2H3