ethyl (3Z)-3-[[[4-(3-azanylpropyl)phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-1H-indole-6-carboxylate

Systemtic Name: ethyl (3Z)-3-[[[4-(3-azanylpropyl)phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-1H-indole-6-carboxylate Openeye Name: ethyl (3Z)-3-[[4-(3-aminopropyl)anilino]-phenyl-methylene]-2-oxo-indoline-6-carboxylate CAS Name: (3Z)-3-[[4-(3-aminopropyl)anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylic acid ethyl ester IUPAC Name: ethyl (3Z)-3-[[4-(3-aminopropyl)anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylate Traditional Name: (3Z)-3-[[4-(3-aminopropyl)anilino]-phenyl-methylene]-2-keto-indoline-6-carboxylic acid ethyl ester Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)C(=C(C3=CC=CC=C3)NC4=CC=C(C=C4)CCCN)C(=O)N2

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)/C(=C(\C3=CC=CC=C3)/NC4=CC=C(C=C4)CCCN)/C(=O)N2

InChI

InChI=1S/C27H27N3O3/c1-2-33-27(32)20-12-15-22-23(17-20)30-26(31)24(22)25(19-8-4-3-5-9-19)29-21-13-10-18(11-14-21)7-6-16-28/h3-5,8-15,17,29H,2,6-7,16,28H2,1H3,(H,30,31)/b25-24-