1-(1-methylbenzotriazol-5-yl)carbonyl-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(1-methylbenzotriazol-5-yl)carbonyl-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(1-methylbenzotriazole-5-carbonyl)-N-(m-tolylmethyl)piperidine-4-carboxamide CAS Name: 1-[(1-methyl-5-benzotriazolyl)-oxomethyl]-N-[(3-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(1-methylbenzotriazole-5-carbonyl)-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(1-methylbenzotriazole-5-carbonyl)-N-(3-methylbenzyl)isonipecotamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C

InChI

InChI=1S/C22H25N5O2/c1-15-4-3-5-16(12-15)14-23-21(28)17-8-10-27(11-9-17)22(29)18-6-7-20-19(13-18)24-25-26(20)2/h3-7,12-13,17H,8-11,14H2,1-2H3,(H,23,28)