methyl 3-[[4-[6-[(3-methoxycarbonyl-5-nitro-phenyl)carbonylamino]-1H-benzimidazol-2-yl]phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[4-[6-[(3-methoxycarbonyl-5-nitro-phenyl)carbonylamino]-1H-benzimidazol-2-yl]phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[4-[6-[(3-methoxycarbonyl-5-nitro-benzoyl)amino]-1H-benzimidazol-2-yl]phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4-[6-[[(3-methoxycarbonyl-5-nitrophenyl)-oxomethyl]amino]-1H-benzimidazol-2-yl]anilino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[4-[6-[(3-methoxycarbonyl-5-nitrobenzoyl)amino]-1H-benzimidazol-2-yl]phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[4-[6-[(3-carbomethoxy-5-nitro-benzoyl)amino]-1H-benzimidazol-2-yl]phenyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C31H22N6O10 MolecularWeight: 638.54058

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC(=O)C5=CC(=CC(=C5)[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC(=O)C5=CC(=CC(=C5)[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C31H22N6O10/c1-46-30(40)19-9-17(11-23(13-19)36(42)43)28(38)32-21-5-3-16(4-6-21)27-34-25-8-7-22(15-26(25)35-27)33-29(39)18-10-20(31(41)47-2)14-24(12-18)37(44)45/h3-15H,1-2H3,(H,32,38)(H,33,39)(H,34,35)