N-[(E)-[2-(1-adamantyl)-2-methyl-propylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[2-(1-adamantyl)-2-methyl-propylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[2-(1-adamantyl)-2-methyl-propylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(E)-[2-(1-adamantyl)-2-methylpropylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-[2-(1-adamantyl)-2-methylpropylidene]amino]-2,4-dinitroaniline Traditional Name: [(E)-[2-(1-adamantyl)-2-methyl-propylidene]amino]-(2,4-dinitrophenyl)amine Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)(/C=N/NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26N4O4/c1-19(2,20-9-13-5-14(10-20)7-15(6-13)11-20)12-21-22-17-4-3-16(23(25)26)8-18(17)24(27)28/h3-4,8,12-15,22H,5-7,9-11H2,1-2H3/b21-12+