(3S)-2-oxidanylidene-3-(2-phenylethanoylamino)-3,4-dihydrochromene-8-carboxylic acid

Systemtic Name: (3S)-2-oxidanylidene-3-(2-phenylethanoylamino)-3,4-dihydrochromene-8-carboxylic acid Openeye Name: (3S)-2-oxo-3-[(2-phenylacetyl)amino]chromane-8-carboxylic acid CAS Name: (3S)-2-oxo-3-[(1-oxo-2-phenylethyl)amino]-3,4-dihydro-2H-1-benzopyran-8-carboxylic acid IUPAC Name: (3S)-2-oxo-3-[(2-phenylacetyl)amino]-3,4-dihydrochromene-8-carboxylic acid Traditional Name: (3S)-2-keto-3-[(2-phenylacetyl)amino]chroman-8-carboxylic acid Formula: C18H15NO5 MolecularWeight: 325.3154

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)OC2=C(C=CC=C21)C(=O)O)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1[C@@H](C(=O)OC2=C(C=CC=C21)C(=O)O)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H15NO5/c20-15(9-11-5-2-1-3-6-11)19-14-10-12-7-4-8-13(17(21)22)16(12)24-18(14)23/h1-8,14H,9-10H2,(H,19,20)(H,21,22)/t14-/m0/s1