N-[2-[(4-azanyl-3-nitro-phenyl)carbonylamino]ethyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-[(4-azanyl-3-nitro-phenyl)carbonylamino]ethyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-[(4-amino-3-nitro-benzoyl)amino]ethyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[[(4-amino-3-nitrophenyl)-oxomethyl]amino]ethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-[(4-amino-3-nitrobenzoyl)amino]ethyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[(4-amino-3-nitro-benzoyl)amino]ethyl]-1-methyl-pyrrole-2-carboxamide Formula: C15H17N5O4 MolecularWeight: 331.32658

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NCCNC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C(=O)NCCNC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O4/c1-19-8-2-3-12(19)15(22)18-7-6-17-14(21)10-4-5-11(16)13(9-10)20(23)24/h2-5,8-9H,6-7,16H2,1H3,(H,17,21)(H,18,22)