(2S)-2-[(3,4-dimethoxyphenyl)methylcarbamoylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[(3,4-dimethoxyphenyl)methylcarbamoylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(3,4-dimethoxyphenyl)methylcarbamoylamino]-4-methyl-pentanoate CAS Name: (2S)-2-[[[(3,4-dimethoxyphenyl)methylamino]-oxomethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(3,4-dimethoxyphenyl)methylcarbamoylamino]-4-methylpentanoate Traditional Name: (2S)-4-methyl-2-(veratrylcarbamoylamino)valerate Formula: C16H23N2O5- MolecularWeight: 323.36422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)NCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)NCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C16H24N2O5/c1-10(2)7-12(15(19)20)18-16(21)17-9-11-5-6-13(22-3)14(8-11)23-4/h5-6,8,10,12H,7,9H2,1-4H3,(H,19,20)(H2,17,18,21)/p-1/t12-/m0/s1