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

Systemtic Name: methyl 4-[2-[(6-chloranyl-3,4-dihydro-2H-chromen-3-yl)carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[(6-chlorochromane-3-carbonyl)amino]ethyl]benzoate CAS Name: 4-[2-[[(6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl)-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(6-chloro-3,4-dihydro-2H-chromene-3-carbonyl)amino]ethyl]benzoate Traditional Name: 4-[2-[(6-chlorochroman-3-carbonyl)amino]ethyl]benzoic acid methyl ester Formula: C20H20ClNO4 MolecularWeight: 373.8301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClNO4/c1-25-20(24)14-4-2-13(3-5-14)8-9-22-19(23)16-10-15-11-17(21)6-7-18(15)26-12-16/h2-7,11,16H,8-10,12H2,1H3,(H,22,23)