[1-[(2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 1-(cyclopropylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: [1-[(2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 1-(cyclopropylcarbamoyl)piperidine-4-carboxylate Openeye Name: [2-(2-methoxy-5-methyl-anilino)-1-methyl-2-oxo-ethyl] 1-(cyclopropylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[(cyclopropylamino)-oxomethyl]-4-piperidinecarboxylic acid [1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl] 1-(cyclopropylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(cyclopropylcarbamoyl)isonipecotic acid [2-keto-2-(2-methoxy-5-methyl-anilino)-1-methyl-ethyl] ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(C)OC(=O)C2CCN(CC2)C(=O)NC3CC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C(C)OC(=O)C2CCN(CC2)C(=O)NC3CC3

InChI

InChI=1S/C21H29N3O5/c1-13-4-7-18(28-3)17(12-13)23-19(25)14(2)29-20(26)15-8-10-24(11-9-15)21(27)22-16-5-6-16/h4,7,12,14-16H,5-6,8-11H2,1-3H3,(H,22,27)(H,23,25)