1-[1-[[1-(2-cyclohexylethyl)-1,2,3-triazol-4-yl]carbonyl]piperidin-3-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[1-[[1-(2-cyclohexylethyl)-1,2,3-triazol-4-yl]carbonyl]piperidin-3-yl]-3-phenyl-propan-1-one Openeye Name: 1-[1-[1-(2-cyclohexylethyl)triazole-4-carbonyl]-3-piperidyl]-3-phenyl-propan-1-one CAS Name: 1-[1-[[1-(2-cyclohexylethyl)-4-triazolyl]-oxomethyl]-3-piperidinyl]-3-phenyl-1-propanone IUPAC Name: 1-[1-[1-(2-cyclohexylethyl)triazole-4-carbonyl]piperidin-3-yl]-3-phenylpropan-1-one Traditional Name: 1-[1-[1-(2-cyclohexylethyl)triazole-4-carbonyl]-3-piperidyl]-3-phenyl-propan-1-one Formula: C25H34N4O2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCN2C=C(N=N2)C(=O)N3CCCC(C3)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CCN2C=C(N=N2)C(=O)N3CCCC(C3)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H34N4O2/c30-24(14-13-20-8-3-1-4-9-20)22-12-7-16-28(18-22)25(31)23-19-29(27-26-23)17-15-21-10-5-2-6-11-21/h1,3-4,8-9,19,21-22H,2,5-7,10-18H2