2-[2-[(4-cyanophenyl)carbonylamino]-3,4-dihydro-2H-chromen-3-yl]ethanoic acid

Systemtic Name: 2-[2-[(4-cyanophenyl)carbonylamino]-3,4-dihydro-2H-chromen-3-yl]ethanoic acid Openeye Name: 2-[2-[(4-cyanobenzoyl)amino]chroman-3-yl]acetic acid CAS Name: 2-[2-[[(4-cyanophenyl)-oxomethyl]amino]-3,4-dihydro-2H-1-benzopyran-3-yl]acetic acid IUPAC Name: 2-[2-[(4-cyanobenzoyl)amino]-3,4-dihydro-2H-chromen-3-yl]acetic acid Traditional Name: 2-[2-[(4-cyanobenzoyl)amino]chroman-3-yl]acetic acid Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)C#N)CC(=O)O

Isomeric SMILES

C1C(C(OC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)C#N)CC(=O)O

InChI

InChI=1S/C19H16N2O4/c20-11-12-5-7-13(8-6-12)18(24)21-19-15(10-17(22)23)9-14-3-1-2-4-16(14)25-19/h1-8,15,19H,9-10H2,(H,21,24)(H,22,23)