(2S)-N-[4-[3-(aminomethyl)phenoxy]butyl]-2-azanyl-3-methyl-butanamide

Systemtic Name: (2S)-N-[4-[3-(aminomethyl)phenoxy]butyl]-2-azanyl-3-methyl-butanamide Openeye Name: (2S)-2-amino-N-[4-[3-(aminomethyl)phenoxy]butyl]-3-methyl-butanamide CAS Name: (2S)-2-amino-N-[4-[3-(aminomethyl)phenoxy]butyl]-3-methylbutanamide IUPAC Name: (2S)-2-amino-N-[4-[3-(aminomethyl)phenoxy]butyl]-3-methylbutanamide Traditional Name: (2S)-2-amino-N-[4-[3-(aminomethyl)phenoxy]butyl]-3-methyl-butyramide Formula: C16H27N3O2 MolecularWeight: 293.40448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCCCOC1=CC=CC(=C1)CN)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCCCOC1=CC=CC(=C1)CN)N

InChI

InChI=1S/C16H27N3O2/c1-12(2)15(18)16(20)19-8-3-4-9-21-14-7-5-6-13(10-14)11-17/h5-7,10,12,15H,3-4,8-9,11,17-18H2,1-2H3,(H,19,20)/t15-/m0/s1