2-[2-[4-(phenylcarbonyl)phenoxy]butanoylamino]-2-(prop-2-enoylamino)ethanoic acid

Systemtic Name: 2-[2-[4-(phenylcarbonyl)phenoxy]butanoylamino]-2-(prop-2-enoylamino)ethanoic acid Openeye Name: 2-[2-(4-benzoylphenoxy)butanoylamino]-2-(prop-2-enoylamino)acetic acid CAS Name: 2-[[2-(4-benzoylphenoxy)-1-oxobutyl]amino]-2-(1-oxoprop-2-enylamino)acetic acid IUPAC Name: 2-[2-(4-benzoylphenoxy)butanoylamino]-2-(prop-2-enoylamino)acetic acid Traditional Name: 2-acrylamido-2-[2-(4-benzoylphenoxy)butanoylamino]acetic acid Formula: C22H22N2O6 MolecularWeight: 410.41988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C(=O)O)NC(=O)C=C)OC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)NC(C(=O)O)NC(=O)C=C)OC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H22N2O6/c1-3-17(21(27)24-20(22(28)29)23-18(25)4-2)30-16-12-10-15(11-13-16)19(26)14-8-6-5-7-9-14/h4-13,17,20H,2-3H2,1H3,(H,23,25)(H,24,27)(H,28,29)