2-[[1-(2-methylpropyl)-4-[(5-nitro-1H-indol-2-yl)carbonylamino]pyrrol-2-yl]carbonylamino]ethylcarbamic acid

Systemtic Name: 2-[[1-(2-methylpropyl)-4-[(5-nitro-1H-indol-2-yl)carbonylamino]pyrrol-2-yl]carbonylamino]ethylcarbamic acid Openeye Name: 2-[[1-isobutyl-4-[(5-nitro-1H-indole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]ethylcarbamic acid CAS Name: 2-[[[1-(2-methylpropyl)-4-[[(5-nitro-1H-indol-2-yl)-oxomethyl]amino]-2-pyrrolyl]-oxomethyl]amino]ethylcarbamic acid IUPAC Name: 2-[[1-(2-methylpropyl)-4-[(5-nitro-1H-indole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]ethylcarbamic acid Traditional Name: 2-[[1-isobutyl-4-[(5-nitro-1H-indole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]ethylcarbamic acid Formula: C21H24N6O6 MolecularWeight: 456.45186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C=C1C(=O)NCCNC(=O)O)NC(=O)C2=CC3=C(N2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1C=C(C=C1C(=O)NCCNC(=O)O)NC(=O)C2=CC3=C(N2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N6O6/c1-12(2)10-26-11-14(9-18(26)20(29)22-5-6-23-21(30)31)24-19(28)17-8-13-7-15(27(32)33)3-4-16(13)25-17/h3-4,7-9,11-12,23,25H,5-6,10H2,1-2H3,(H,22,29)(H,24,28)(H,30,31)