ethyl 1-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]-3-[(3-methoxyphenyl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]-3-[(3-methoxyphenyl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(2-ethoxy-2-oxo-ethyl)carbamoyl]-3-[(3-methoxyphenyl)methyl]piperidine-3-carboxylate CAS Name: 1-[[(2-ethoxy-2-oxoethyl)amino]-oxomethyl]-3-[(3-methoxyphenyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-ethoxy-2-oxoethyl)carbamoyl]-3-[(3-methoxyphenyl)methyl]piperidine-3-carboxylate Traditional Name: 1-[(2-ethoxy-2-keto-ethyl)carbamoyl]-3-m-anisyl-nipecotic acid ethyl ester Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)N1CCCC(C1)(CC2=CC(=CC=C2)OC)C(=O)OCC

Isomeric SMILES

CCOC(=O)CNC(=O)N1CCCC(C1)(CC2=CC(=CC=C2)OC)C(=O)OCC

InChI

InChI=1S/C21H30N2O6/c1-4-28-18(24)14-22-20(26)23-11-7-10-21(15-23,19(25)29-5-2)13-16-8-6-9-17(12-16)27-3/h6,8-9,12H,4-5,7,10-11,13-15H2,1-3H3,(H,22,26)