3-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)carbonylamino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(5-chloro-2,3-dihydro-1,4-benzodioxine-7-carbonyl)amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-carbonyl)amino]-5-phenyl-2-thenoic acid Formula: C20H14ClNO5S MolecularWeight: 415.84686

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NC3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C20H14ClNO5S/c21-13-8-12(9-15-17(13)27-7-6-26-15)19(23)22-14-10-16(28-18(14)20(24)25)11-4-2-1-3-5-11/h1-5,8-10H,6-7H2,(H,22,23)(H,24,25)