2-[4-[4-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)cyclohexyl]carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[4-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)cyclohexyl]carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[[4-[3,4-dihydro-2H-quinolin-1-yl(oxo)methyl]cyclohexyl]-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)cyclohexanecarbonyl]piperazino]acetic acid Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)C3CCC(CC3)C(=O)N4CCN(CC4)CC(=O)O

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)C3CCC(CC3)C(=O)N4CCN(CC4)CC(=O)O

InChI

InChI=1S/C23H31N3O4/c27-21(28)16-24-12-14-25(15-13-24)22(29)18-7-9-19(10-8-18)23(30)26-11-3-5-17-4-1-2-6-20(17)26/h1-2,4,6,18-19H,3,5,7-16H2,(H,27,28)