5-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-3-methyl-2-oxidanyl-benzoic acid

Systemtic Name: 5-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-3-methyl-2-oxidanyl-benzoic acid Openeye Name: 5-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-2-hydroxy-3-methyl-benzoic acid CAS Name: 5-[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-2-hydroxy-3-methylbenzoic acid IUPAC Name: 5-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-2-hydroxy-3-methylbenzoic acid Traditional Name: 5-[[(E)-3-(4-chlorophenyl)acryloyl]amino]-2-hydroxy-3-methyl-benzoic acid Formula: C17H14ClNO4 MolecularWeight: 331.75036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)NC(=O)C=CC2=CC=C(C=C2)Cl)C(=O)O)O

Isomeric SMILES

CC1=C(C(=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)Cl)C(=O)O)O

InChI

InChI=1S/C17H14ClNO4/c1-10-8-13(9-14(16(10)21)17(22)23)19-15(20)7-4-11-2-5-12(18)6-3-11/h2-9,21H,1H3,(H,19,20)(H,22,23)/b7-4+