N-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(Z)-(5-methyl-2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)methyleneamino]amine Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(N(C=C2C1)C3=CC=CC=C3)C=NNC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1CCC2=C(N(C=C2C1)C3=CC=CC=C3)/C=N\NC4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O4/c1-15-7-9-19-16(11-15)14-25(17-5-3-2-4-6-17)22(19)13-23-24-20-10-8-18(26(28)29)12-21(20)27(30)31/h2-6,8,10,12-15,24H,7,9,11H2,1H3/b23-13-