3-azanyl-4-[[1-methoxy-3-[(2-methylphenyl)methoxy]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[[1-methoxy-3-[(2-methylphenyl)methoxy]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[2-methoxy-1-(o-tolylmethoxymethyl)-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[1-methoxy-3-[(2-methylphenyl)methoxy]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[1-methoxy-3-[(2-methylphenyl)methoxy]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-keto-4-[[2-keto-2-methoxy-1-[(2-methylbenzyl)oxymethyl]ethyl]amino]butyric acid Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COCC(C(=O)OC)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CC1=CC=CC=C1COCC(C(=O)OC)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C16H22N2O6/c1-10-5-3-4-6-11(10)8-24-9-13(16(22)23-2)18-15(21)12(17)7-14(19)20/h3-6,12-13H,7-9,17H2,1-2H3,(H,18,21)(H,19,20)