1-[(2S)-2-azanyl-2-[4-(2-methylpropyl)phenyl]ethyl]azepan-2-one

Systemtic Name: 1-[(2S)-2-azanyl-2-[4-(2-methylpropyl)phenyl]ethyl]azepan-2-one Openeye Name: 1-[(2S)-2-amino-2-(4-isobutylphenyl)ethyl]azepan-2-one CAS Name: 1-[(2S)-2-amino-2-[4-(2-methylpropyl)phenyl]ethyl]-2-azepanone IUPAC Name: 1-[(2S)-2-amino-2-[4-(2-methylpropyl)phenyl]ethyl]azepan-2-one Traditional Name: 1-[(2S)-2-amino-2-(4-isobutylphenyl)ethyl]azepan-2-one Formula: C18H28N2O MolecularWeight: 288.42772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(CN2CCCCCC2=O)N

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)[C@@H](CN2CCCCCC2=O)N

InChI

InChI=1S/C18H28N2O/c1-14(2)12-15-7-9-16(10-8-15)17(19)13-20-11-5-3-4-6-18(20)21/h7-10,14,17H,3-6,11-13,19H2,1-2H3/t17-/m1/s1