ethyl 6,7-dimethoxy-4-[4-[(4-phenoxyphenyl)carbamoyl]piperazin-1-yl]quinoline-3-carboxylate

Systemtic Name: ethyl 6,7-dimethoxy-4-[4-[(4-phenoxyphenyl)carbamoyl]piperazin-1-yl]quinoline-3-carboxylate Openeye Name: ethyl 6,7-dimethoxy-4-[4-[(4-phenoxyphenyl)carbamoyl]piperazin-1-yl]quinoline-3-carboxylate CAS Name: 6,7-dimethoxy-4-[4-[oxo-(4-phenoxyanilino)methyl]-1-piperazinyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dimethoxy-4-[4-[(4-phenoxyphenyl)carbamoyl]piperazin-1-yl]quinoline-3-carboxylate Traditional Name: 6,7-dimethoxy-4-[4-[(4-phenoxyphenyl)carbamoyl]piperazino]quinoline-3-carboxylic acid ethyl ester Formula: C31H32N4O6 MolecularWeight: 556.60898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1)OC)OC)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1)OC)OC)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C31H32N4O6/c1-4-40-30(36)25-20-32-26-19-28(39-3)27(38-2)18-24(26)29(25)34-14-16-35(17-15-34)31(37)33-21-10-12-23(13-11-21)41-22-8-6-5-7-9-22/h5-13,18-20H,4,14-17H2,1-3H3,(H,33,37)