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

Systemtic Name: ethyl (3R)-3-(4-methoxyphenyl)-3-[(6-nitro-2-oxidanylidene-chromen-3-yl)carbonylamino]propanoate Openeye Name: ethyl (3R)-3-(4-methoxyphenyl)-3-[(6-nitro-2-oxo-chromene-3-carbonyl)amino]propanoate CAS Name: (3R)-3-(4-methoxyphenyl)-3-[[(6-nitro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (3R)-3-(4-methoxyphenyl)-3-[(6-nitro-2-oxochromene-3-carbonyl)amino]propanoate Traditional Name: (3R)-3-[(2-keto-6-nitro-chromene-3-carbonyl)amino]-3-(4-methoxyphenyl)propionic acid ethyl ester Formula: C22H20N2O8 MolecularWeight: 440.4028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=C(C=C1)OC)NC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CCOC(=O)C[C@H](C1=CC=C(C=C1)OC)NC(=O)C2=CC3=C(C=CC(=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C22H20N2O8/c1-3-31-20(25)12-18(13-4-7-16(30-2)8-5-13)23-21(26)17-11-14-10-15(24(28)29)6-9-19(14)32-22(17)27/h4-11,18H,3,12H2,1-2H3,(H,23,26)/t18-/m1/s1