N-[(E)-1-(4-methoxyphenyl)propan-2-ylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-1-(4-methoxyphenyl)propan-2-ylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[2-(4-methoxyphenyl)-1-methyl-ethylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(E)-1-(4-methoxyphenyl)propan-2-ylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-1-(4-methoxyphenyl)propan-2-ylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-[2-(4-methoxyphenyl)-1-methyl-ethylidene]amino]amine Formula: C16H16N4O5 MolecularWeight: 344.32204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CC2=CC=C(C=C2)OC

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/CC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H16N4O5/c1-11(9-12-3-6-14(25-2)7-4-12)17-18-15-8-5-13(19(21)22)10-16(15)20(23)24/h3-8,10,18H,9H2,1-2H3/b17-11+