N-[4-(2-methylpropanoylamino)phenyl]-1-naphthalen-1-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-(2-methylpropanoylamino)phenyl]-1-naphthalen-1-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[4-(2-methylpropanoylamino)phenyl]-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide CAS Name: N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-1-[1-naphthalenyl(oxo)methyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(2-methylpropanoylamino)phenyl]-1-(naphthalene-1-carbonyl)piperidine-3-carboxamide Traditional Name: N-[4-(isobutyrylamino)phenyl]-1-(1-naphthoyl)nipecotamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H29N3O3/c1-18(2)25(31)28-21-12-14-22(15-13-21)29-26(32)20-9-6-16-30(17-20)27(33)24-11-5-8-19-7-3-4-10-23(19)24/h3-5,7-8,10-15,18,20H,6,9,16-17H2,1-2H3,(H,28,31)(H,29,32)