(2-benzamido-2-oxidanylidene-ethyl) (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: (2-benzamido-2-oxo-ethyl) (3S)-6-chlorochromane-3-carboxylate CAS Name: (3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) (3S)-6-chloro-3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: (3S)-6-chlorochroman-3-carboxylic acid (2-benzamido-2-keto-ethyl) ester Formula: C19H16ClNO5 MolecularWeight: 373.78704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=C(C=C2)Cl)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1[C@@H](COC2=C1C=C(C=C2)Cl)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H16ClNO5/c20-15-6-7-16-13(9-15)8-14(10-25-16)19(24)26-11-17(22)21-18(23)12-4-2-1-3-5-12/h1-7,9,14H,8,10-11H2,(H,21,22,23)/t14-/m0/s1