ethyl 4-[2-(3,4-dimethylphenyl)-8-methyl-quinolin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(3,4-dimethylphenyl)-8-methyl-quinolin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3,4-dimethylphenyl)-8-methyl-quinoline-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(3,4-dimethylphenyl)-8-methyl-4-quinolinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3,4-dimethylphenyl)-8-methylquinoline-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3,4-dimethylphenyl)-8-methyl-quinoline-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC(=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=CC=C3C)C4=CC(=C(C=C4)C)C

InChI

InChI=1S/C26H29N3O3/c1-5-32-26(31)29-13-11-28(12-14-29)25(30)22-16-23(20-10-9-17(2)19(4)15-20)27-24-18(3)7-6-8-21(22)24/h6-10,15-16H,5,11-14H2,1-4H3