(2S)-N-[3-(aminomethyl)phenyl]-2-(azepan-1-yl)propanamide

Systemtic Name: (2S)-N-[3-(aminomethyl)phenyl]-2-(azepan-1-yl)propanamide Openeye Name: (2S)-N-[3-(aminomethyl)phenyl]-2-(azepan-1-yl)propanamide CAS Name: (2S)-N-[3-(aminomethyl)phenyl]-2-(1-azepanyl)propanamide IUPAC Name: (2S)-N-[3-(aminomethyl)phenyl]-2-(azepan-1-yl)propanamide Traditional Name: (2S)-N-[3-(aminomethyl)phenyl]-2-(azepan-1-yl)propionamide Formula: C16H25N3O MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)CN)N2CCCCCC2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC(=C1)CN)N2CCCCCC2

InChI

InChI=1S/C16H25N3O/c1-13(19-9-4-2-3-5-10-19)16(20)18-15-8-6-7-14(11-15)12-17/h6-8,11,13H,2-5,9-10,12,17H2,1H3,(H,18,20)/t13-/m0/s1