ethyl 1-[2-(1H-imidazol-2-yl)phenyl]carbonyl-3-phenethyl-piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(1H-imidazol-2-yl)phenyl]carbonyl-3-phenethyl-piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(1H-imidazol-2-yl)benzoyl]-3-phenethyl-piperidine-3-carboxylate CAS Name: 1-[[2-(1H-imidazol-2-yl)phenyl]-oxomethyl]-3-phenethyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(1H-imidazol-2-yl)benzoyl]-3-phenethylpiperidine-3-carboxylate Traditional Name: 1-[2-(1H-imidazol-2-yl)benzoyl]-3-phenethyl-nipecotic acid ethyl ester Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=CC=C2C3=NC=CN3)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC=CC=C2C3=NC=CN3)CCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3/c1-2-32-25(31)26(15-13-20-9-4-3-5-10-20)14-8-18-29(19-26)24(30)22-12-7-6-11-21(22)23-27-16-17-28-23/h3-7,9-12,16-17H,2,8,13-15,18-19H2,1H3,(H,27,28)