4-[(prop-2-enoylamino)methyl]benzoic acid

Systemtic Name: 4-[(prop-2-enoylamino)methyl]benzoic acid Openeye Name: 4-[(prop-2-enoylamino)methyl]benzoic acid CAS Name: 4-[(1-oxoprop-2-enylamino)methyl]benzoic acid IUPAC Name: 4-[(prop-2-enoylamino)methyl]benzoic acid Traditional Name: 4-(acrylamidomethyl)benzoic acid Formula: C11H11NO3 MolecularWeight: 205.20994

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NCC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

C=CC(=O)NCC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C11H11NO3/c1-2-10(13)12-7-8-3-5-9(6-4-8)11(14)15/h2-6H,1,7H2,(H,12,13)(H,14,15)