methyl 2-[3-[(4-nitrophenyl)carbonylamino]propanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[3-[(4-nitrophenyl)carbonylamino]propanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[3-[(4-nitrobenzoyl)amino]propanoyloxymethyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[[3-[[(4-nitrophenyl)-oxomethyl]amino]-1-oxopropoxy]methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-[(4-nitrobenzoyl)amino]propanoyloxymethyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[3-[(4-nitrobenzoyl)amino]propanoyloxymethyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C28H23N3O7 MolecularWeight: 513.49812

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C28H23N3O7/c1-37-28(34)26-23(30-22-10-6-5-9-21(22)25(26)18-7-3-2-4-8-18)17-38-24(32)15-16-29-27(33)19-11-13-20(14-12-19)31(35)36/h2-14H,15-17H2,1H3,(H,29,33)