N-[1-[(3-chlorophenyl)methyl]-6-cyano-3,4-dihydro-2H-quinolin-3-yl]-2-cyclohexyl-ethanamide

Systemtic Name: N-[1-[(3-chlorophenyl)methyl]-6-cyano-3,4-dihydro-2H-quinolin-3-yl]-2-cyclohexyl-ethanamide Openeye Name: N-[1-[(3-chlorophenyl)methyl]-6-cyano-3,4-dihydro-2H-quinolin-3-yl]-2-cyclohexyl-acetamide CAS Name: N-[1-[(3-chlorophenyl)methyl]-6-cyano-3,4-dihydro-2H-quinolin-3-yl]-2-cyclohexylacetamide IUPAC Name: N-[1-[(3-chlorophenyl)methyl]-6-cyano-3,4-dihydro-2H-quinolin-3-yl]-2-cyclohexylacetamide Traditional Name: N-[1-(3-chlorobenzyl)-6-cyano-3,4-dihydro-2H-quinolin-3-yl]-2-cyclohexyl-acetamide Formula: C25H28ClN3O MolecularWeight: 421.96232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NC2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCC(CC1)CC(=O)NC2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H28ClN3O/c26-22-8-4-7-20(12-22)16-29-17-23(14-21-11-19(15-27)9-10-24(21)29)28-25(30)13-18-5-2-1-3-6-18/h4,7-12,18,23H,1-3,5-6,13-14,16-17H2,(H,28,30)