N-(3-chloranyl-4-methoxy-phenyl)-1-(1-cyclopentylbenzotriazol-5-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-1-(1-cyclopentylbenzotriazol-5-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-1-[(1-cyclopentyl-5-benzotriazolyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-1-(1-cyclopentylbenzotriazole-5-carbonyl)isonipecotamide Formula: C25H28ClN5O3 MolecularWeight: 481.97452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C5CCCC5)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C5CCCC5)Cl

InChI

InChI=1S/C25H28ClN5O3/c1-34-23-9-7-18(15-20(23)26)27-24(32)16-10-12-30(13-11-16)25(33)17-6-8-22-21(14-17)28-29-31(22)19-4-2-3-5-19/h6-9,14-16,19H,2-5,10-13H2,1H3,(H,27,32)