N-(3-azanyl-3-propylimino-propyl)-1-(3-methylbutyl)-4-nitro-pyrrole-2-carboxamide

Systemtic Name: N-(3-azanyl-3-propylimino-propyl)-1-(3-methylbutyl)-4-nitro-pyrrole-2-carboxamide Openeye Name: N-(3-amino-3-propylimino-propyl)-1-isopentyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-(3-amino-3-propyliminopropyl)-1-(3-methylbutyl)-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-(3-amino-3-propyliminopropyl)-1-(3-methylbutyl)-4-nitropyrrole-2-carboxamide Traditional Name: N-(3-amino-3-propylimino-propyl)-1-isoamyl-4-nitro-pyrrole-2-carboxamide Formula: C16H27N5O3 MolecularWeight: 337.41728

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(CCNC(=O)C1=CC(=CN1CCC(C)C)[N+](=O)[O-])N

Isomeric SMILES

CCCN=C(CCNC(=O)C1=CC(=CN1CCC(C)C)[N+](=O)[O-])N

InChI

InChI=1S/C16H27N5O3/c1-4-7-18-15(17)5-8-19-16(22)14-10-13(21(23)24)11-20(14)9-6-12(2)3/h10-12H,4-9H2,1-3H3,(H2,17,18)(H,19,22)