4-(7-acetamido-4-oxidanylidene-3-propyl-chromen-2-yl)benzoic acid

Systemtic Name: 4-(7-acetamido-4-oxidanylidene-3-propyl-chromen-2-yl)benzoic acid Openeye Name: 4-(7-acetamido-4-oxo-3-propyl-chromen-2-yl)benzoic acid CAS Name: 4-(7-acetamido-4-oxo-3-propyl-1-benzopyran-2-yl)benzoic acid IUPAC Name: 4-(7-acetamido-4-oxo-3-propylchromen-2-yl)benzoic acid Traditional Name: 4-(7-acetamido-4-keto-3-propyl-chromen-2-yl)benzoic acid Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC2=C(C1=O)C=CC(=C2)NC(=O)C)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCC1=C(OC2=C(C1=O)C=CC(=C2)NC(=O)C)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H19NO5/c1-3-4-17-19(24)16-10-9-15(22-12(2)23)11-18(16)27-20(17)13-5-7-14(8-6-13)21(25)26/h5-11H,3-4H2,1-2H3,(H,22,23)(H,25,26)