1-naphthalen-1-ylcarbonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide

Systemtic Name: 1-naphthalen-1-ylcarbonyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide Openeye Name: 1-(naphthalene-1-carbonyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide CAS Name: 1-[1-naphthalenyl(oxo)methyl]-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(naphthalene-1-carbonyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]piperidine-3-carboxamide Traditional Name: 1-(1-naphthoyl)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]nipecotamide Formula: C27H27N5O2 MolecularWeight: 453.53558

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC3=CC=CC=C32)C(=O)NCC4=CC=C(C=C4)CN5C=NC=N5

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CC3=CC=CC=C32)C(=O)NCC4=CC=C(C=C4)CN5C=NC=N5

InChI

InChI=1S/C27H27N5O2/c33-26(29-15-20-10-12-21(13-11-20)16-32-19-28-18-30-32)23-7-4-14-31(17-23)27(34)25-9-3-6-22-5-1-2-8-24(22)25/h1-3,5-6,8-13,18-19,23H,4,7,14-17H2,(H,29,33)