N-[3-(4-azanylbutylamino)propyl]-1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrole-2-carboxamide

Systemtic Name: N-[3-(4-azanylbutylamino)propyl]-1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrole-2-carboxamide Openeye Name: N-[3-(4-aminobutylamino)propyl]-1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carboxamide CAS Name: N-[3-(4-aminobutylamino)propyl]-1-methyl-4-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-2-pyrrolecarboxamide IUPAC Name: N-[3-(4-aminobutylamino)propyl]-1-methyl-4-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrrole-2-carboxamide Traditional Name: N-[3-(4-aminobutylamino)propyl]-1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carboxamide Formula: C19H29N7O4 MolecularWeight: 419.47806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCCNCCCCN)NC(=O)C2=CC(=CN2C)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCCNCCCCN)NC(=O)C2=CC(=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C19H29N7O4/c1-24-12-14(23-19(28)17-11-15(26(29)30)13-25(17)2)10-16(24)18(27)22-9-5-8-21-7-4-3-6-20/h10-13,21H,3-9,20H2,1-2H3,(H,22,27)(H,23,28)