N-butyl-1-[(2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]piperidine-4-carboxamide

Systemtic Name: N-butyl-1-[(2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]piperidine-4-carboxamide Openeye Name: N-butyl-1-(2-ethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide CAS Name: N-butyl-1-[(2-ethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-butyl-1-(2-ethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-butyl-1-(2-ethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)isonipecotamide Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CCN(CC1)C(=O)N2CC(OC3=CC=CC=C32)CC

Isomeric SMILES

CCCCNC(=O)C1CCN(CC1)C(=O)N2CC(OC3=CC=CC=C32)CC

InChI

InChI=1S/C21H31N3O3/c1-3-5-12-22-20(25)16-10-13-23(14-11-16)21(26)24-15-17(4-2)27-19-9-7-6-8-18(19)24/h6-9,16-17H,3-5,10-15H2,1-2H3,(H,22,25)