1-butyl-3-ethyl-3-(1-phenylpropan-2-ylamino)azepan-2-one

Systemtic Name: 1-butyl-3-ethyl-3-(1-phenylpropan-2-ylamino)azepan-2-one Openeye Name: 1-butyl-3-ethyl-3-[(1-methyl-2-phenyl-ethyl)amino]azepan-2-one CAS Name: 1-butyl-3-ethyl-3-(1-phenylpropan-2-ylamino)-2-azepanone IUPAC Name: 1-butyl-3-ethyl-3-(1-phenylpropan-2-ylamino)azepan-2-one Traditional Name: 1-butyl-3-ethyl-3-[(1-methyl-2-phenyl-ethyl)amino]azepan-2-one Formula: C21H34N2O MolecularWeight: 330.50746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCCC(C1=O)(CC)NC(C)CC2=CC=CC=C2

Isomeric SMILES

CCCCN1CCCCC(C1=O)(CC)NC(C)CC2=CC=CC=C2

InChI

InChI=1S/C21H34N2O/c1-4-6-15-23-16-11-10-14-21(5-2,20(23)24)22-18(3)17-19-12-8-7-9-13-19/h7-9,12-13,18,22H,4-6,10-11,14-17H2,1-3H3