N-[(E)-(8-methyl-2,3,6,7-tetrahydro-1H-azulen-5-ylidene)amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-(8-methyl-2,3,6,7-tetrahydro-1H-azulen-5-ylidene)amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-(8-methyl-2,3,6,7-tetrahydro-1H-azulen-5-ylidene)amino]-2,4-dinitro-aniline CAS Name: N-[(E)-(8-methyl-2,3,6,7-tetrahydro-1H-azulen-5-ylidene)amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-(8-methyl-2,3,6,7-tetrahydro-1H-azulen-5-ylidene)amino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-(8-methyl-2,3,6,7-tetrahydro-1H-azulen-5-ylidene)amino]amine Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCC2=CC(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])CC1

Isomeric SMILES

CC1=C2CCCC2=C/C(=N/NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])/CC1

InChI

InChI=1S/C17H18N4O4/c1-11-5-6-13(9-12-3-2-4-15(11)12)18-19-16-8-7-14(20(22)23)10-17(16)21(24)25/h7-10,19H,2-6H2,1H3/b18-13+