(2S)-2-[(4-dimethylaminophenyl)methyl-ethanoyl-amino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[(4-dimethylaminophenyl)methyl-ethanoyl-amino]-3-methyl-butanoate Openeye Name: (2S)-2-[acetyl-[(4-dimethylaminophenyl)methyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[acetyl-[(4-dimethylaminophenyl)methyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[acetyl-[(4-dimethylaminophenyl)methyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[acetyl-[4-(dimethylamino)benzyl]amino]-3-methyl-butyrate Formula: C16H23N2O3- MolecularWeight: 291.36542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])N(CC1=CC=C(C=C1)N(C)C)C(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])N(CC1=CC=C(C=C1)N(C)C)C(=O)C

InChI

InChI=1S/C16H24N2O3/c1-11(2)15(16(20)21)18(12(3)19)10-13-6-8-14(9-7-13)17(4)5/h6-9,11,15H,10H2,1-5H3,(H,20,21)/p-1/t15-/m0/s1