(2-aminocarbonyl-3-cyclohexyl-4-pyridin-3-yl-phenyl) benzoate hydrochloride

Systemtic Name: (2-aminocarbonyl-3-cyclohexyl-4-pyridin-3-yl-phenyl) benzoate hydrochloride Openeye Name: [2-carbamoyl-3-cyclohexyl-4-(3-pyridyl)phenyl] benzoate hydrochloride CAS Name: benzoic acid [2-carbamoyl-3-cyclohexyl-4-(3-pyridinyl)phenyl] ester hydrochloride IUPAC Name: (2-carbamoyl-3-cyclohexyl-4-pyridin-3-ylphenyl) benzoate hydrochloride Traditional Name: benzoic acid [2-carbamoyl-3-cyclohexyl-4-(3-pyridyl)phenyl] ester hydrochloride Formula: C25H25ClN2O3 MolecularWeight: 436.9306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=CC(=C2C(=O)N)OC(=O)C3=CC=CC=C3)C4=CN=CC=C4.Cl

Isomeric SMILES

C1CCC(CC1)C2=C(C=CC(=C2C(=O)N)OC(=O)C3=CC=CC=C3)C4=CN=CC=C4.Cl

InChI

InChI=1S/C25H24N2O3.ClH/c26-24(28)23-21(30-25(29)18-10-5-2-6-11-18)14-13-20(19-12-7-15-27-16-19)22(23)17-8-3-1-4-9-17;/h2,5-7,10-17H,1,3-4,8-9H2,(H2,26,28);1H