2-[[2-azanyl-3-(3,4-diacetyloxyphenyl)propanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[2-azanyl-3-(3,4-diacetyloxyphenyl)propanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-amino-3-(3,4-diacetoxyphenyl)propanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-amino-3-(3,4-diacetyloxyphenyl)-1-oxopropyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-amino-3-(3,4-diacetyloxyphenyl)propanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-amino-3-(3,4-diacetoxyphenyl)propanoyl]amino]-3-phenyl-propionic acid Formula: C22H24N2O7 MolecularWeight: 428.43516

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)NC(CC2=CC=CC=C2)C(=O)O)N)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)NC(CC2=CC=CC=C2)C(=O)O)N)OC(=O)C

InChI

InChI=1S/C22H24N2O7/c1-13(25)30-19-9-8-16(12-20(19)31-14(2)26)10-17(23)21(27)24-18(22(28)29)11-15-6-4-3-5-7-15/h3-9,12,17-18H,10-11,23H2,1-2H3,(H,24,27)(H,28,29)