3-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylate

Systemtic Name: 3-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylate Openeye Name: 3-[2-(3-cyanoanilino)-2-oxo-ethyl]-1H-indole-2-carboxylate CAS Name: 3-[2-(3-cyanoanilino)-2-oxoethyl]-1H-indole-2-carboxylate IUPAC Name: 3-[2-(3-cyanoanilino)-2-oxoethyl]-1H-indole-2-carboxylate Traditional Name: 3-[2-(3-cyanoanilino)-2-keto-ethyl]-1H-indole-2-carboxylate Formula: C18H12N3O3- MolecularWeight: 318.30618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C(=O)[O-])CC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C(=O)[O-])CC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H13N3O3/c19-10-11-4-3-5-12(8-11)20-16(22)9-14-13-6-1-2-7-15(13)21-17(14)18(23)24/h1-8,21H,9H2,(H,20,22)(H,23,24)/p-1