3-[[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]sulfonylphenyl]carbonyl-propan-2-yl-amino]propanoic acid

Systemtic Name: 3-[[4-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]sulfonylphenyl]carbonyl-propan-2-yl-amino]propanoic acid Openeye Name: 3-[[4-(2,5-dioxopyrrolidin-1-yl)sulfonylbenzoyl]-isopropyl-amino]propanoic acid CAS Name: 3-[[[4-[(2,5-dioxo-1-pyrrolidinyl)sulfonyl]phenyl]-oxomethyl]-propan-2-ylamino]propanoic acid IUPAC Name: 3-[[4-(2,5-dioxopyrrolidin-1-yl)sulfonylbenzoyl]-propan-2-ylamino]propanoic acid Traditional Name: 3-[isopropyl-(4-succinimidosulfonylbenzoyl)amino]propionic acid Formula: C17H20N2O7S MolecularWeight: 396.4149

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCC(=O)O)C(=O)C1=CC=C(C=C1)S(=O)(=O)N2C(=O)CCC2=O

Isomeric SMILES

CC(C)N(CCC(=O)O)C(=O)C1=CC=C(C=C1)S(=O)(=O)N2C(=O)CCC2=O

InChI

InChI=1S/C17H20N2O7S/c1-11(2)18(10-9-16(22)23)17(24)12-3-5-13(6-4-12)27(25,26)19-14(20)7-8-15(19)21/h3-6,11H,7-10H2,1-2H3,(H,22,23)