N-(2-azanylethyl)-1-(3-methylbutyl)-4-nitro-pyrrole-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3-methylbutyl)-4-nitro-pyrrole-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-isopentyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-(2-aminoethyl)-1-(3-methylbutyl)-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-methylbutyl)-4-nitropyrrole-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-isoamyl-4-nitro-pyrrole-2-carboxamide Formula: C12H20N4O3 MolecularWeight: 268.3122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C=C1C(=O)NCCN)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN1C=C(C=C1C(=O)NCCN)[N+](=O)[O-]

InChI

InChI=1S/C12H20N4O3/c1-9(2)3-6-15-8-10(16(18)19)7-11(15)12(17)14-5-4-13/h7-9H,3-6,13H2,1-2H3,(H,14,17)