[1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-(4-imidazol-1-ylphenyl)methanone

Systemtic Name: [1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-(4-imidazol-1-ylphenyl)methanone Openeye Name: [1-[2-(3,4-dimethoxyphenyl)ethyl]-4-piperidyl]-(4-imidazol-1-ylphenyl)methanone CAS Name: [1-[2-(3,4-dimethoxyphenyl)ethyl]-4-piperidinyl]-[4-(1-imidazolyl)phenyl]methanone IUPAC Name: [1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-4-yl]-(4-imidazol-1-ylphenyl)methanone Traditional Name: (1-homoveratryl-4-piperidyl)-(4-imidazol-1-ylphenyl)methanone Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CCC(CC2)C(=O)C3=CC=C(C=C3)N4C=CN=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CCC(CC2)C(=O)C3=CC=C(C=C3)N4C=CN=C4)OC

InChI

InChI=1S/C25H29N3O3/c1-30-23-8-3-19(17-24(23)31-2)9-13-27-14-10-21(11-15-27)25(29)20-4-6-22(7-5-20)28-16-12-26-18-28/h3-8,12,16-18,21H,9-11,13-15H2,1-2H3