[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(4-cyanoanilino)-2-oxo-ethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-cyanoanilino)-2-oxoethyl] 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 2-phenyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(4-cyanoanilino)-2-keto-ethyl] ester Formula: C29H23N3O3 MolecularWeight: 461.51122

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=CC=CC=C3C(=C2CC1C4=CC=CC=C4)C(=O)OCC(=O)NC5=CC=C(C=C5)C#N

Isomeric SMILES

C1CC2=NC3=CC=CC=C3C(=C2CC1C4=CC=CC=C4)C(=O)OCC(=O)NC5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H23N3O3/c30-17-19-10-13-22(14-11-19)31-27(33)18-35-29(34)28-23-8-4-5-9-25(23)32-26-15-12-21(16-24(26)28)20-6-2-1-3-7-20/h1-11,13-14,21H,12,15-16,18H2,(H,31,33)