4-[(Z)-[3-[(4-ethoxyphenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]amino]sulfonylbenzoic acid

Systemtic Name: 4-[(Z)-[3-[(4-ethoxyphenyl)amino]-4-oxidanylidene-naphthalen-1-ylidene]amino]sulfonylbenzoic acid Openeye Name: 4-[(Z)-[3-(4-ethoxyanilino)-4-oxo-1-naphthylidene]amino]sulfonylbenzoic acid CAS Name: 4-[(Z)-[3-(4-ethoxyanilino)-4-oxo-1-naphthalenylidene]amino]sulfonylbenzoic acid IUPAC Name: 4-[(Z)-[3-(4-ethoxyanilino)-4-oxonaphthalen-1-ylidene]amino]sulfonylbenzoic acid Traditional Name: 4-[(Z)-[4-keto-3-(p-phenetidino)-1-naphthylidene]amino]sulfonylbenzoic acid Formula: C25H20N2O6S MolecularWeight: 476.5011

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=CC(=NS(=O)(=O)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4C2=O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C/C(=N/S(=O)(=O)C3=CC=C(C=C3)C(=O)O)/C4=CC=CC=C4C2=O

InChI

InChI=1S/C25H20N2O6S/c1-2-33-18-11-9-17(10-12-18)26-23-15-22(20-5-3-4-6-21(20)24(23)28)27-34(31,32)19-13-7-16(8-14-19)25(29)30/h3-15,26H,2H2,1H3,(H,29,30)/b27-22-