3-phenylbutyl 2-oxidanyl-5-[[(E)-(3-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate

Systemtic Name: 3-phenylbutyl 2-oxidanyl-5-[[(E)-(3-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate Openeye Name: 3-phenylbutyl 2-hydroxy-5-[[(E)-(3-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate CAS Name: 2-hydroxy-5-[[(E)-(3-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]benzoic acid 3-phenylbutyl ester IUPAC Name: 3-phenylbutyl 2-hydroxy-5-[[(E)-(3-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoate Traditional Name: 2-hydroxy-5-[[(E)-(3-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]benzoic acid 3-phenylbutyl ester Formula: C24H23NO5 MolecularWeight: 405.44312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)C1=C(C=CC(=C1)NC=C2C=C(C=CC2=O)O)O)C3=CC=CC=C3

Isomeric SMILES

CC(CCOC(=O)C1=C(C=CC(=C1)N/C=C/2\C=C(C=CC2=O)O)O)C3=CC=CC=C3

InChI

InChI=1S/C24H23NO5/c1-16(17-5-3-2-4-6-17)11-12-30-24(29)21-14-19(7-9-23(21)28)25-15-18-13-20(26)8-10-22(18)27/h2-10,13-16,25-26,28H,11-12H2,1H3/b18-15+