(2S)-3-methyl-2-[(4-propan-2-ylphenyl)methylcarbamoylamino]butanoate

Systemtic Name: (2S)-3-methyl-2-[(4-propan-2-ylphenyl)methylcarbamoylamino]butanoate Openeye Name: (2S)-2-[(4-isopropylphenyl)methylcarbamoylamino]-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-[[oxo-[(4-propan-2-ylphenyl)methylamino]methyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-[(4-propan-2-ylphenyl)methylcarbamoylamino]butanoate Traditional Name: (2S)-2-[(4-isopropylbenzyl)carbamoylamino]-3-methyl-butyrate Formula: C16H23N2O3- MolecularWeight: 291.36542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CNC(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O3/c1-10(2)13-7-5-12(6-8-13)9-17-16(21)18-14(11(3)4)15(19)20/h5-8,10-11,14H,9H2,1-4H3,(H,19,20)(H2,17,18,21)/p-1/t14-/m0/s1