N-[(3,6-dimethoxyxanthen-9-ylidene)amino]-2,4-dinitro-aniline

Systemtic Name: N-[(3,6-dimethoxyxanthen-9-ylidene)amino]-2,4-dinitro-aniline Openeye Name: N-[(3,6-dimethoxyxanthen-9-ylidene)amino]-2,4-dinitro-aniline CAS Name: N-[(3,6-dimethoxy-9-xanthenylidene)amino]-2,4-dinitroaniline IUPAC Name: N-[(3,6-dimethoxyxanthen-9-ylidene)amino]-2,4-dinitroaniline Traditional Name: [(3,6-dimethoxyxanthen-9-ylidene)amino]-(2,4-dinitrophenyl)amine Formula: C21H16N4O7 MolecularWeight: 436.37434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=C(O2)C=C(C=C4)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=C(O2)C=C(C=C4)OC

InChI

InChI=1S/C21H16N4O7/c1-30-13-4-6-15-19(10-13)32-20-11-14(31-2)5-7-16(20)21(15)23-22-17-8-3-12(24(26)27)9-18(17)25(28)29/h3-11,22H,1-2H3