ethyl 6-(dimethylamino)-3-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-oxidanylidene-1H-quinoline-2-carboxylate

Systemtic Name: ethyl 6-(dimethylamino)-3-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-4-oxidanylidene-1H-quinoline-2-carboxylate Openeye Name: ethyl 3-[(4-benzhydrylpiperazin-1-yl)methyl]-6-(dimethylamino)-4-oxo-1H-quinoline-2-carboxylate CAS Name: 6-(dimethylamino)-3-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-4-oxo-1H-quinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-benzhydrylpiperazin-1-yl)methyl]-6-(dimethylamino)-4-oxo-1H-quinoline-2-carboxylate Traditional Name: 3-[(4-benzhydrylpiperazino)methyl]-6-(dimethylamino)-4-keto-1H-quinoline-2-carboxylic acid ethyl ester Formula: C32H36N4O3 MolecularWeight: 524.65324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(N1)C=CC(=C2)N(C)C)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H36N4O3/c1-4-39-32(38)29-27(31(37)26-21-25(34(2)3)15-16-28(26)33-29)22-35-17-19-36(20-18-35)30(23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-16,21,30H,4,17-20,22H2,1-3H3,(H,33,37)