3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-4-methoxy-benzoic acid

Systemtic Name: 3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-4-methoxy-benzoic acid Openeye Name: 3-[(3-chlorobenzothiophene-2-carbonyl)amino]-4-methoxy-benzoic acid CAS Name: 3-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-4-methoxybenzoic acid IUPAC Name: 3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-methoxybenzoic acid Traditional Name: 3-[(3-chlorobenzothiophene-2-carbonyl)amino]-4-methoxy-benzoic acid Formula: C17H12ClNO4S MolecularWeight: 361.79948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H12ClNO4S/c1-23-12-7-6-9(17(21)22)8-11(12)19-16(20)15-14(18)10-4-2-3-5-13(10)24-15/h2-8H,1H3,(H,19,20)(H,21,22)