methyl 5-[[[(3R)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonylamino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[[(3R)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonylamino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[[(3R)-6-chlorochromane-3-carbonyl]amino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[[(3R)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl]-oxomethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[[(3R)-6-chloro-3,4-dihydro-2H-chromene-3-carbonyl]amino]methyl]-2-methoxybenzoate Traditional Name: 5-[[[(3R)-6-chlorochroman-3-carbonyl]amino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C20H20ClNO5 MolecularWeight: 389.8295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2CC3=C(C=CC(=C3)Cl)OC2)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)[C@@H]2CC3=C(C=CC(=C3)Cl)OC2)C(=O)OC

InChI

InChI=1S/C20H20ClNO5/c1-25-18-5-3-12(7-16(18)20(24)26-2)10-22-19(23)14-8-13-9-15(21)4-6-17(13)27-11-14/h3-7,9,14H,8,10-11H2,1-2H3,(H,22,23)/t14-/m1/s1