ethyl 4-[(4-pyrrolidin-1-ylphenyl)amino]benzo[h]quinoline-3-carboxylate

Systemtic Name: ethyl 4-[(4-pyrrolidin-1-ylphenyl)amino]benzo[h]quinoline-3-carboxylate Openeye Name: ethyl 4-(4-pyrrolidin-1-ylanilino)benzo[h]quinoline-3-carboxylate CAS Name: 4-[4-(1-pyrrolidinyl)anilino]-3-benzo[h]quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-pyrrolidin-1-ylanilino)benzo[h]quinoline-3-carboxylate Traditional Name: 4-(4-pyrrolidinoanilino)benzo[h]quinoline-3-carboxylic acid ethyl ester Formula: C26H25N3O2 MolecularWeight: 411.4956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3=CC=C(C=C3)N4CCCC4)C=CC5=CC=CC=C52

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3=CC=C(C=C3)N4CCCC4)C=CC5=CC=CC=C52

InChI

InChI=1S/C26H25N3O2/c1-2-31-26(30)23-17-27-24-21-8-4-3-7-18(21)9-14-22(24)25(23)28-19-10-12-20(13-11-19)29-15-5-6-16-29/h3-4,7-14,17H,2,5-6,15-16H2,1H3,(H,27,28)