(2S,3S)-2-azanyl-3-methyl-N-[3-[methyl(phenyl)amino]propyl]pentanamide

Systemtic Name: (2S,3S)-2-azanyl-3-methyl-N-[3-[methyl(phenyl)amino]propyl]pentanamide Openeye Name: (2S,3S)-2-amino-3-methyl-N-[3-(N-methylanilino)propyl]pentanamide CAS Name: (2S,3S)-2-amino-3-methyl-N-[3-(N-methylanilino)propyl]pentanamide IUPAC Name: (2S,3S)-2-amino-3-methyl-N-[3-(N-methylanilino)propyl]pentanamide Traditional Name: (2S,3S)-2-amino-3-methyl-N-[3-(N-methylanilino)propyl]valeramide Formula: C16H27N3O MolecularWeight: 277.40508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCCCN(C)C1=CC=CC=C1)N

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3O/c1-4-13(2)15(17)16(20)18-11-8-12-19(3)14-9-6-5-7-10-14/h5-7,9-10,13,15H,4,8,11-12,17H2,1-3H3,(H,18,20)/t13-,15-/m0/s1