N-[(Z)-4-(4-methoxyphenyl)butan-2-ylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(Z)-4-(4-methoxyphenyl)butan-2-ylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(Z)-[3-(4-methoxyphenyl)-1-methyl-propylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(Z)-4-(4-methoxyphenyl)butan-2-ylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(Z)-4-(4-methoxyphenyl)butan-2-ylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(Z)-[3-(4-methoxyphenyl)-1-methyl-propylidene]amino]amine Formula: C17H18N4O5 MolecularWeight: 358.34862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CCC2=CC=C(C=C2)OC

Isomeric SMILES

C/C(=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/CCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H18N4O5/c1-12(3-4-13-5-8-15(26-2)9-6-13)18-19-16-10-7-14(20(22)23)11-17(16)21(24)25/h5-11,19H,3-4H2,1-2H3/b18-12-