1-[4-(benzotriazol-1-ylmethyl)phenyl]carbonyl-N-(2-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-(benzotriazol-1-ylmethyl)phenyl]carbonyl-N-(2-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[4-(benzotriazol-1-ylmethyl)benzoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[[4-(1-benzotriazolylmethyl)phenyl]-oxomethyl]-N-(2-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[4-(benzotriazol-1-ylmethyl)benzoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[4-(benzotriazol-1-ylmethyl)benzoyl]-N-(2-methoxyphenyl)isonipecotamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C27H27N5O3/c1-35-25-9-5-3-7-23(25)28-26(33)20-14-16-31(17-15-20)27(34)21-12-10-19(11-13-21)18-32-24-8-4-2-6-22(24)29-30-32/h2-13,20H,14-18H2,1H3,(H,28,33)