1-[(3-azanyl-2-methyl-phenyl)methyl]azepan-2-one

Systemtic Name: 1-[(3-azanyl-2-methyl-phenyl)methyl]azepan-2-one Openeye Name: 1-[(3-amino-2-methyl-phenyl)methyl]azepan-2-one CAS Name: 1-[(3-amino-2-methylphenyl)methyl]-2-azepanone IUPAC Name: 1-[(3-amino-2-methylphenyl)methyl]azepan-2-one Traditional Name: 1-(3-amino-2-methyl-benzyl)azepan-2-one Formula: C14H20N2O MolecularWeight: 232.3214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N)CN2CCCCCC2=O

Isomeric SMILES

CC1=C(C=CC=C1N)CN2CCCCCC2=O

InChI

InChI=1S/C14H20N2O/c1-11-12(6-5-7-13(11)15)10-16-9-4-2-3-8-14(16)17/h5-7H,2-4,8-10,15H2,1H3