ethyl 1-[3-(2-methylimidazol-1-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(2-methylimidazol-1-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(2-methylimidazol-1-yl)propanoyl]-4-phenethyl-piperidine-4-carboxylate CAS Name: 1-[3-(2-methyl-1-imidazolyl)-1-oxopropyl]-4-phenethyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-methylimidazol-1-yl)propanoyl]-4-phenethylpiperidine-4-carboxylate Traditional Name: 1-[3-(2-methylimidazol-1-yl)propanoyl]-4-phenethyl-isonipecotic acid ethyl ester Formula: C23H31N3O3 MolecularWeight: 397.51054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)CCN2C=CN=C2C)CCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)CCN2C=CN=C2C)CCC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3/c1-3-29-22(28)23(11-9-20-7-5-4-6-8-20)12-16-26(17-13-23)21(27)10-15-25-18-14-24-19(25)2/h4-8,14,18H,3,9-13,15-17H2,1-2H3