3-[(2-carboxylato-1H-indol-3-yl)-(5-chloranyl-3-nitro-2-oxidanidyl-phenyl)methyl]-1H-indole-2-carboxylate

Systemtic Name: 3-[(2-carboxylato-1H-indol-3-yl)-(5-chloranyl-3-nitro-2-oxidanidyl-phenyl)methyl]-1H-indole-2-carboxylate Openeye Name: 3-[(2-carboxylato-1H-indol-3-yl)-(5-chloro-3-nitro-2-oxido-phenyl)methyl]-1H-indole-2-carboxylate CAS Name: 3-[(2-carboxylato-1H-indol-3-yl)-(5-chloro-3-nitro-2-oxidophenyl)methyl]-1H-indole-2-carboxylate IUPAC Name: 3-[(2-carboxylato-1H-indol-3-yl)-(5-chloro-3-nitro-2-oxidophenyl)methyl]-1H-indole-2-carboxylate Traditional Name: 3-[(2-carboxylato-1H-indol-3-yl)-(5-chloro-3-nitro-2-oxido-phenyl)methyl]-1H-indole-2-carboxylate Formula: C25H13ClN3O7-3 MolecularWeight: 502.83962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C(=O)[O-])C(C3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl)C4=C(NC5=CC=CC=C54)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C(=O)[O-])C(C3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl)C4=C(NC5=CC=CC=C54)C(=O)[O-]

InChI

InChI=1S/C25H16ClN3O7/c26-11-9-14(23(30)17(10-11)29(35)36)18(19-12-5-1-3-7-15(12)27-21(19)24(31)32)20-13-6-2-4-8-16(13)28-22(20)25(33)34/h1-10,18,27-28,30H,(H,31,32)(H,33,34)/p-3