methyl 4-[[[(3R)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[(3R)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[(3R)-6-chlorochromane-3-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[(3R)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(3R)-6-chloro-3,4-dihydro-2H-chromene-3-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[(3R)-6-chlorochroman-3-carbonyl]amino]methyl]benzoic acid methyl ester Formula: C19H18ClNO4 MolecularWeight: 359.80352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CC3=C(C=CC(=C3)Cl)OC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)[C@@H]2CC3=C(C=CC(=C3)Cl)OC2

InChI

InChI=1S/C19H18ClNO4/c1-24-19(23)13-4-2-12(3-5-13)10-21-18(22)15-8-14-9-16(20)6-7-17(14)25-11-15/h2-7,9,15H,8,10-11H2,1H3,(H,21,22)/t15-/m1/s1