N-[(Z)-[2-(2-azanylidenepyrrolidin-1-yl)-1-phenyl-ethylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(Z)-[2-(2-azanylidenepyrrolidin-1-yl)-1-phenyl-ethylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(Z)-[2-(2-iminopyrrolidin-1-yl)-1-phenyl-ethylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(Z)-[2-(2-imino-1-pyrrolidinyl)-1-phenylethylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(Z)-[2-(2-iminopyrrolidin-1-yl)-1-phenylethylidene]amino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(Z)-[2-(2-iminopyrrolidino)-1-phenyl-ethylidene]amino]amine Formula: C18H18N6O4 MolecularWeight: 382.37332

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=N)N(C1)CC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1CC(=N)N(C1)C/C(=N\NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/C3=CC=CC=C3

InChI

InChI=1S/C18H18N6O4/c19-18-7-4-10-22(18)12-16(13-5-2-1-3-6-13)21-20-15-9-8-14(23(25)26)11-17(15)24(27)28/h1-3,5-6,8-9,11,19-20H,4,7,10,12H2/b19-18?,21-16+