N-[(E)-[1-(1-adamantyl)-2-phenyl-ethylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[1-(1-adamantyl)-2-phenyl-ethylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[1-(1-adamantyl)-2-phenyl-ethylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(E)-[1-(1-adamantyl)-2-phenylethylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-[1-(1-adamantyl)-2-phenylethylidene]amino]-2,4-dinitroaniline Traditional Name: [(E)-[1-(1-adamantyl)-2-phenyl-ethylidene]amino]-(2,4-dinitrophenyl)amine Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=NNC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)/C(=N/NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])/CC5=CC=CC=C5

InChI

InChI=1S/C24H26N4O4/c29-27(30)20-6-7-21(22(12-20)28(31)32)25-26-23(11-16-4-2-1-3-5-16)24-13-17-8-18(14-24)10-19(9-17)15-24/h1-7,12,17-19,25H,8-11,13-15H2/b26-23+