dimethyl 2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[(2S)-2-amino-4-methylpentanoyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC)N

InChI

InChI=1S/C16H22N2O5/c1-9(2)7-12(17)14(19)18-13-8-10(15(20)22-3)5-6-11(13)16(21)23-4/h5-6,8-9,12H,7,17H2,1-4H3,(H,18,19)/t12-/m0/s1