1-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-(4-nitrophenyl)prop-2-en-1-one

Systemtic Name: 1-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-(4-nitrophenyl)prop-2-en-1-one Openeye Name: 1-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-(4-nitrophenyl)prop-2-en-1-one CAS Name: 1-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-3-(4-nitrophenyl)-2-propen-1-one IUPAC Name: 1-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-(4-nitrophenyl)prop-2-en-1-one Traditional Name: 1-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3-(4-nitrophenyl)prop-2-en-1-one Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H18N2O3/c1-15-3-4-16(2)22(15)19-12-8-18(9-13-19)21(24)14-7-17-5-10-20(11-6-17)23(25)26/h3-14H,1-2H3