methyl 2-[(6-cyano-5,6,7,8-tetrahydronaphthalen-2-yl)carbonylamino]-3-cyclohexyl-propanoate hydrochloride

Systemtic Name: methyl 2-[(6-cyano-5,6,7,8-tetrahydronaphthalen-2-yl)carbonylamino]-3-cyclohexyl-propanoate hydrochloride Openeye Name: methyl 2-[(2-cyanotetralin-6-carbonyl)amino]-3-cyclohexyl-propanoate hydrochloride CAS Name: 2-[[(6-cyano-5,6,7,8-tetrahydronaphthalen-2-yl)-oxomethyl]amino]-3-cyclohexylpropanoic acid methyl ester hydrochloride IUPAC Name: methyl 2-[(6-cyano-5,6,7,8-tetrahydronaphthalene-2-carbonyl)amino]-3-cyclohexylpropanoate hydrochloride Traditional Name: 2-[(2-cyanotetralin-6-carbonyl)amino]-3-cyclohexyl-propionic acid methyl ester hydrochloride Formula: C22H29ClN2O3 MolecularWeight: 404.93026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1CCCCC1)NC(=O)C2=CC3=C(CC(CC3)C#N)C=C2.Cl

Isomeric SMILES

COC(=O)C(CC1CCCCC1)NC(=O)C2=CC3=C(CC(CC3)C#N)C=C2.Cl

InChI

InChI=1S/C22H28N2O3.ClH/c1-27-22(26)20(12-15-5-3-2-4-6-15)24-21(25)19-10-9-17-11-16(14-23)7-8-18(17)13-19;/h9-10,13,15-16,20H,2-8,11-12H2,1H3,(H,24,25);1H