4-[chloranyl(methyl)amino]benzoic acid; 3-methylbicyclo[2.2.1]hepta-1,3,5-trien-7-one

Systemtic Name: 4-[chloranyl(methyl)amino]benzoic acid; 3-methylbicyclo[2.2.1]hepta-1,3,5-trien-7-one Openeye Name: 4-[chloro(methyl)amino]benzoic acid; 3-methylbicyclo[2.2.1]hepta-1,3,5-trien-7-one CAS Name: 4-[chloro(methyl)amino]benzoic acid; 3-methyl-7-bicyclo[2.2.1]hepta-1,3,5-trienone IUPAC Name: 4-[chloro(methyl)amino]benzoic acid; 3-methylbicyclo[2.2.1]hepta-1,3,5-trien-7-one Traditional Name: 4-[chloro(methyl)amino]benzoic acid; 3-methylbicyclo[2.2.1]hepta-1,3,5-trien-7-one Formula: C16H14ClNO3 MolecularWeight: 303.74026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=C1)C2=O.CN(C1=CC=C(C=C1)C(=O)O)Cl

Isomeric SMILES

CC1=C2C=CC(=C1)C2=O.CN(C1=CC=C(C=C1)C(=O)O)Cl

InChI

InChI=1S/C8H8ClNO2.C8H6O/c1-10(9)7-4-2-6(3-5-7)8(11)12;1-5-4-6-2-3-7(5)8(6)9/h2-5H,1H3,(H,11,12);2-4H,1H3