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

Systemtic Name: N-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethenyl]-2,4-dinitro-aniline Openeye Name: N-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]vinyl]-2,4-dinitro-aniline CAS Name: N-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]ethenyl]-2,4-dinitroaniline IUPAC Name: N-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]ethenyl]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]vinyl]amine Formula: C21H20N4O5 MolecularWeight: 408.4073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=CNC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O5/c1-14-12-16(15(2)23(14)17-4-7-19(30-3)8-5-17)10-11-22-20-9-6-18(24(26)27)13-21(20)25(28)29/h4-13,22H,1-3H3/b11-10+