2-[(3-azanyl-4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanoyl)-(phenylmethyl)amino]propanoic acid

Systemtic Name: 2-[(3-azanyl-4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanoyl)-(phenylmethyl)amino]propanoic acid Openeye Name: 2-[(3-amino-4-methoxy-2-methoxycarbonyl-4-oxo-butanoyl)-benzyl-amino]propanoic acid CAS Name: 2-[(3-amino-4-methoxy-2-methoxycarbonyl-1,4-dioxobutyl)-(phenylmethyl)amino]propanoic acid IUPAC Name: 2-[(3-amino-4-methoxy-2-methoxycarbonyl-4-oxobutanoyl)-benzylamino]propanoic acid Traditional Name: 2-[(3-amino-2-carbomethoxy-4-keto-4-methoxy-butanoyl)-benzyl-amino]propionic acid Formula: C17H22N2O7 MolecularWeight: 366.36578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(CC1=CC=CC=C1)C(=O)C(C(C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC(C(=O)O)N(CC1=CC=CC=C1)C(=O)C(C(C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C17H22N2O7/c1-10(15(21)22)19(9-11-7-5-4-6-8-11)14(20)12(16(23)25-2)13(18)17(24)26-3/h4-8,10,12-13H,9,18H2,1-3H3,(H,21,22)