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

Systemtic Name: methyl 4-[(6-chloranyl-3,4-dihydro-2H-chromen-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(6-chlorochromane-3-carbonyl)amino]benzoate CAS Name: 4-[[(6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-chloro-3,4-dihydro-2H-chromene-3-carbonyl)amino]benzoate Traditional Name: 4-[(6-chlorochroman-3-carbonyl)amino]benzoic acid methyl ester Formula: C18H16ClNO4 MolecularWeight: 345.77694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClNO4/c1-23-18(22)11-2-5-15(6-3-11)20-17(21)13-8-12-9-14(19)4-7-16(12)24-10-13/h2-7,9,13H,8,10H2,1H3,(H,20,21)