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

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

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NC(C(=O)O)NC(=O)CCCOC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

C=CC(=O)NC(C(=O)O)NC(=O)CCCOC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H22N2O6/c1-2-18(25)23-21(22(28)29)24-19(26)9-6-14-30-17-12-10-16(11-13-17)20(27)15-7-4-3-5-8-15/h2-5,7-8,10-13,21H,1,6,9,14H2,(H,23,25)(H,24,26)(H,28,29)