N-[(E)-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]amine Formula: C20H19N5O5 MolecularWeight: 409.39536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=NNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)/C=N/NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O5/c1-13-10-15(14(2)23(13)16-4-7-18(30-3)8-5-16)12-21-22-19-9-6-17(24(26)27)11-20(19)25(28)29/h4-12,22H,1-3H3/b21-12+