azane; 4-[(Z)-N-ethoxy-C-[4-(4-nitrophenyl)piperazin-1-yl]carbonimidoyl]-1,2-oxazol-3-amine

Systemtic Name: azane; 4-[(Z)-N-ethoxy-C-[4-(4-nitrophenyl)piperazin-1-yl]carbonimidoyl]-1,2-oxazol-3-amine Openeye Name: ammonia; 4-[(Z)-N-ethoxy-C-[4-(4-nitrophenyl)piperazin-1-yl]carbonimidoyl]isoxazol-3-amine CAS Name: ammonia; 4-[(Z)-ethoxyimino-[4-(4-nitrophenyl)-1-piperazinyl]methyl]-3-isoxazolamine IUPAC Name: azane; 4-[(Z)-N-ethoxy-C-[4-(4-nitrophenyl)piperazin-1-yl]carbonimidoyl]-1,2-oxazol-3-amine Traditional Name: ammonia; [4-[(Z)-N-ethoxy-C-[4-(4-nitrophenyl)piperazino]carbonimidoyl]isoxazol-3-yl]amine Formula: C16H23N7O4 MolecularWeight: 377.39832

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C(C1=CON=C1N)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-].N

Isomeric SMILES

CCO/N=C(/C1=CON=C1N)\N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-].N

InChI

InChI=1S/C16H20N6O4.H3N/c1-2-25-19-16(14-11-26-18-15(14)17)21-9-7-20(8-10-21)12-3-5-13(6-4-12)22(23)24;/h3-6,11H,2,7-10H2,1H3,(H2,17,18);1H3/b19-16-;