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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC2=CC(=CC=C2)CN

Isomeric SMILES

C1CCC(=O)N(CC1)CC2=CC(=CC=C2)CN

InChI

InChI=1S/C14H20N2O/c15-10-12-5-4-6-13(9-12)11-16-8-3-1-2-7-14(16)17/h4-6,9H,1-3,7-8,10-11,15H2