ethyl (2S)-2-[(6-chloranyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-2-(3-nitrophenyl)ethanoate

Systemtic Name: ethyl (2S)-2-[(6-chloranyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-2-(3-nitrophenyl)ethanoate Openeye Name: ethyl (2S)-2-[(6-chloro-2-oxo-chromene-3-carbonyl)amino]-2-(3-nitrophenyl)acetate CAS Name: (2S)-2-[[(6-chloro-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-2-(3-nitrophenyl)acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(6-chloro-2-oxochromene-3-carbonyl)amino]-2-(3-nitrophenyl)acetate Traditional Name: (2S)-2-[(6-chloro-2-keto-chromene-3-carbonyl)amino]-2-(3-nitrophenyl)acetic acid ethyl ester Formula: C20H15ClN2O7 MolecularWeight: 430.7953

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClN2O7/c1-2-29-20(26)17(11-4-3-5-14(9-11)23(27)28)22-18(24)15-10-12-8-13(21)6-7-16(12)30-19(15)25/h3-10,17H,2H2,1H3,(H,22,24)/t17-/m0/s1