2-(2-azanylethanoylamino)-3-(3,4-diacetyloxyphenyl)propanoic acid

Systemtic Name: 2-(2-azanylethanoylamino)-3-(3,4-diacetyloxyphenyl)propanoic acid Openeye Name: 2-[(2-aminoacetyl)amino]-3-(3,4-diacetoxyphenyl)propanoic acid CAS Name: 2-[(2-amino-1-oxoethyl)amino]-3-(3,4-diacetyloxyphenyl)propanoic acid IUPAC Name: 2-[(2-aminoacetyl)amino]-3-(3,4-diacetyloxyphenyl)propanoic acid Traditional Name: 3-(3,4-diacetoxyphenyl)-2-(glycylamino)propionic acid Formula: C15H18N2O7 MolecularWeight: 338.31262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)O)NC(=O)CN)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)O)NC(=O)CN)OC(=O)C

InChI

InChI=1S/C15H18N2O7/c1-8(18)23-12-4-3-10(6-13(12)24-9(2)19)5-11(15(21)22)17-14(20)7-16/h3-4,6,11H,5,7,16H2,1-2H3,(H,17,20)(H,21,22)