(3R)-3-azanyl-6-(4-methylphenyl)azepan-2-one

Systemtic Name: (3R)-3-azanyl-6-(4-methylphenyl)azepan-2-one Openeye Name: (3R)-3-amino-6-(p-tolyl)azepan-2-one CAS Name: (3R)-3-amino-6-(4-methylphenyl)-2-azepanone IUPAC Name: (3R)-3-amino-6-(4-methylphenyl)azepan-2-one Traditional Name: (3R)-3-amino-6-(p-tolyl)azepan-2-one Formula: C13H18N2O MolecularWeight: 218.29482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCC(C(=O)NC2)N

Isomeric SMILES

CC1=CC=C(C=C1)C2CC[C@H](C(=O)NC2)N

InChI

InChI=1S/C13H18N2O/c1-9-2-4-10(5-3-9)11-6-7-12(14)13(16)15-8-11/h2-5,11-12H,6-8,14H2,1H3,(H,15,16)/t11?,12-/m1/s1