3-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(6-bromo-2-oxo-chromene-3-carbonyl)amino]-4-methyl-benzoic acid CAS Name: 3-[[(6-bromo-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[(6-bromo-2-oxochromene-3-carbonyl)amino]-4-methylbenzoic acid Traditional Name: 3-[(6-bromo-2-keto-chromene-3-carbonyl)amino]-4-methyl-benzoic acid Formula: C18H12BrNO5 MolecularWeight: 402.19558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C18H12BrNO5/c1-9-2-3-10(17(22)23)8-14(9)20-16(21)13-7-11-6-12(19)4-5-15(11)25-18(13)24/h2-8H,1H3,(H,20,21)(H,22,23)