methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-3-[5-(2-methoxy-2-oxidanylidene-ethoxy)-1H-indol-3-yl]propanoate

Systemtic Name: methyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-3-[5-(2-methoxy-2-oxidanylidene-ethoxy)-1H-indol-3-yl]propanoate Openeye Name: methyl 2-[(4-chloro-3-nitro-benzoyl)amino]-3-[5-(2-methoxy-2-oxo-ethoxy)-1H-indol-3-yl]propanoate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-3-[5-(2-methoxy-2-oxoethoxy)-1H-indol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 2-[(4-chloro-3-nitrobenzoyl)amino]-3-[5-(2-methoxy-2-oxoethoxy)-1H-indol-3-yl]propanoate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]-3-[5-(2-keto-2-methoxy-ethoxy)-1H-indol-3-yl]propionic acid methyl ester Formula: C22H20ClN3O8 MolecularWeight: 489.8625

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC2=C(C=C1)NC=C2CC(C(=O)OC)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)COC1=CC2=C(C=C1)NC=C2CC(C(=O)OC)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN3O8/c1-32-20(27)11-34-14-4-6-17-15(9-14)13(10-24-17)7-18(22(29)33-2)25-21(28)12-3-5-16(23)19(8-12)26(30)31/h3-6,8-10,18,24H,7,11H2,1-2H3,(H,25,28)