N,N-diethyl-1-[[(3S)-1-(4-methoxyphenyl)carbonylpiperidin-3-yl]methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N,N-diethyl-1-[[(3S)-1-(4-methoxyphenyl)carbonylpiperidin-3-yl]methyl]-1,2,3-triazole-4-carboxamide Openeye Name: N,N-diethyl-1-[[(3S)-1-(4-methoxybenzoyl)-3-piperidyl]methyl]triazole-4-carboxamide CAS Name: N,N-diethyl-1-[[(3S)-1-[(4-methoxyphenyl)-oxomethyl]-3-piperidinyl]methyl]-4-triazolecarboxamide IUPAC Name: N,N-diethyl-1-[[(3S)-1-(4-methoxybenzoyl)piperidin-3-yl]methyl]triazole-4-carboxamide Traditional Name: N,N-diethyl-1-[[(3S)-1-p-anisoyl-3-piperidyl]methyl]triazole-4-carboxamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CN(N=N1)CC2CCCN(C2)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)C(=O)C1=CN(N=N1)C[C@H]2CCCN(C2)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H29N5O3/c1-4-24(5-2)21(28)19-15-26(23-22-19)14-16-7-6-12-25(13-16)20(27)17-8-10-18(29-3)11-9-17/h8-11,15-16H,4-7,12-14H2,1-3H3/t16-/m0/s1