4-(7-chloranylquinolin-4-yl)-N-[(2-methylphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(7-chloranylquinolin-4-yl)-N-[(2-methylphenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-(7-chloro-4-quinolyl)-N-(o-tolylmethyl)piperazine-1-carboxamide CAS Name: 4-(7-chloro-4-quinolinyl)-N-[(2-methylphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(7-chloroquinolin-4-yl)-N-[(2-methylphenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-(7-chloro-4-quinolyl)-N-(2-methylbenzyl)piperazine-1-carboxamide Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C22H23ClN4O/c1-16-4-2-3-5-17(16)15-25-22(28)27-12-10-26(11-13-27)21-8-9-24-20-14-18(23)6-7-19(20)21/h2-9,14H,10-13,15H2,1H3,(H,25,28)