N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-1-(2-methyl-1-oxopropyl)-3-piperidinecarboxamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Traditional Name: N-[3-(cyclopropanecarbonylamino)benzyl]-1-isobutyryl-nipecotamide Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)NCC2=CC(=CC=C2)NC(=O)C3CC3

Isomeric SMILES

CC(C)C(=O)N1CCCC(C1)C(=O)NCC2=CC(=CC=C2)NC(=O)C3CC3

InChI

InChI=1S/C21H29N3O3/c1-14(2)21(27)24-10-4-6-17(13-24)19(25)22-12-15-5-3-7-18(11-15)23-20(26)16-8-9-16/h3,5,7,11,14,16-17H,4,6,8-10,12-13H2,1-2H3,(H,22,25)(H,23,26)