[2-[(2-ethanoyl-1-benzofuran-3-yl)amino]-2-oxidanylidene-ethyl] 4-(4-methylpiperidin-1-yl)-3-nitro-benzoate

Systemtic Name: [2-[(2-ethanoyl-1-benzofuran-3-yl)amino]-2-oxidanylidene-ethyl] 4-(4-methylpiperidin-1-yl)-3-nitro-benzoate Openeye Name: [2-[(2-acetylbenzofuran-3-yl)amino]-2-oxo-ethyl] 4-(4-methyl-1-piperidyl)-3-nitro-benzoate CAS Name: 4-(4-methyl-1-piperidinyl)-3-nitrobenzoic acid [2-[(2-acetyl-3-benzofuranyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-acetyl-1-benzofuran-3-yl)amino]-2-oxoethyl] 4-(4-methylpiperidin-1-yl)-3-nitrobenzoate Traditional Name: 4-(4-methylpiperidino)-3-nitro-benzoic acid [2-[(2-acetylbenzofuran-3-yl)amino]-2-keto-ethyl] ester Formula: C25H25N3O7 MolecularWeight: 479.4819

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=C(OC4=CC=CC=C43)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=C(OC4=CC=CC=C43)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C25H25N3O7/c1-15-9-11-27(12-10-15)19-8-7-17(13-20(19)28(32)33)25(31)34-14-22(30)26-23-18-5-3-4-6-21(18)35-24(23)16(2)29/h3-8,13,15H,9-12,14H2,1-2H3,(H,26,30)