ethyl (3R)-3-[(6-chloranyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-3-(4-methylphenyl)propanoate

Systemtic Name: ethyl (3R)-3-[(6-chloranyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-3-(4-methylphenyl)propanoate Openeye Name: ethyl (3R)-3-[(6-chloro-2-oxo-chromene-3-carbonyl)amino]-3-(p-tolyl)propanoate CAS Name: (3R)-3-[[(6-chloro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(6-chloro-2-oxochromene-3-carbonyl)amino]-3-(4-methylphenyl)propanoate Traditional Name: (3R)-3-[(6-chloro-2-keto-chromene-3-carbonyl)amino]-3-(p-tolyl)propionic acid ethyl ester Formula: C22H20ClNO5 MolecularWeight: 413.8509

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=C(C=C1)C)NC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2=O

Isomeric SMILES

CCOC(=O)C[C@H](C1=CC=C(C=C1)C)NC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2=O

InChI

InChI=1S/C22H20ClNO5/c1-3-28-20(25)12-18(14-6-4-13(2)5-7-14)24-21(26)17-11-15-10-16(23)8-9-19(15)29-22(17)27/h4-11,18H,3,12H2,1-2H3,(H,24,26)/t18-/m1/s1