2-[[5-[(5-nitro-1H-indol-2-yl)carbonylamino]-1H-indol-2-yl]carbonylamino]ethylcarbamic acid

Systemtic Name: 2-[[5-[(5-nitro-1H-indol-2-yl)carbonylamino]-1H-indol-2-yl]carbonylamino]ethylcarbamic acid Openeye Name: 2-[[5-[(5-nitro-1H-indole-2-carbonyl)amino]-1H-indole-2-carbonyl]amino]ethylcarbamic acid CAS Name: 2-[[[5-[[(5-nitro-1H-indol-2-yl)-oxomethyl]amino]-1H-indol-2-yl]-oxomethyl]amino]ethylcarbamic acid IUPAC Name: 2-[[5-[(5-nitro-1H-indole-2-carbonyl)amino]-1H-indole-2-carbonyl]amino]ethylcarbamic acid Traditional Name: 2-[[5-[(5-nitro-1H-indole-2-carbonyl)amino]-1H-indole-2-carbonyl]amino]ethylcarbamic acid Formula: C21H18N6O6 MolecularWeight: 450.40422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)C3=CC4=C(N3)C=CC(=C4)[N+](=O)[O-])C=C(N2)C(=O)NCCNC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)C3=CC4=C(N3)C=CC(=C4)[N+](=O)[O-])C=C(N2)C(=O)NCCNC(=O)O

InChI

InChI=1S/C21H18N6O6/c28-19(22-5-6-23-21(30)31)17-9-11-7-13(1-3-15(11)25-17)24-20(29)18-10-12-8-14(27(32)33)2-4-16(12)26-18/h1-4,7-10,23,25-26H,5-6H2,(H,22,28)(H,24,29)(H,30,31)