N-[(E)-[3-(1,2-dimethylindol-3-yl)-1-phenyl-propylidene]amino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[3-(1,2-dimethylindol-3-yl)-1-phenyl-propylidene]amino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[3-(1,2-dimethylindol-3-yl)-1-phenyl-propylidene]amino]-2,4-dinitro-aniline CAS Name: N-[(E)-[3-(1,2-dimethyl-3-indolyl)-1-phenylpropylidene]amino]-2,4-dinitroaniline IUPAC Name: N-[(E)-[3-(1,2-dimethylindol-3-yl)-1-phenylpropylidene]amino]-2,4-dinitroaniline Traditional Name: [(E)-[3-(1,2-dimethylindol-3-yl)-1-phenyl-propylidene]amino]-(2,4-dinitrophenyl)amine Formula: C25H23N5O4 MolecularWeight: 457.48122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)CCC(=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)CC/C(=N\NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])/C4=CC=CC=C4

InChI

InChI=1S/C25H23N5O4/c1-17-20(21-10-6-7-11-24(21)28(17)2)13-15-22(18-8-4-3-5-9-18)26-27-23-14-12-19(29(31)32)16-25(23)30(33)34/h3-12,14,16,27H,13,15H2,1-2H3/b26-22+