2-(4-bromophenyl)-3-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]prop-2-enenitrile

Systemtic Name: 2-(4-bromophenyl)-3-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]prop-2-enenitrile Openeye Name: 2-(4-bromophenyl)-3-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]prop-2-enenitrile CAS Name: 2-(4-bromophenyl)-3-[2,5-dimethyl-1-(3-nitrophenyl)-3-pyrrolyl]-2-propenenitrile IUPAC Name: 2-(4-bromophenyl)-3-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]prop-2-enenitrile Traditional Name: 2-(4-bromophenyl)-3-[2,5-dimethyl-1-(3-nitrophenyl)pyrrol-3-yl]acrylonitrile Formula: C21H16BrN3O2 MolecularWeight: 422.27464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16BrN3O2/c1-14-10-17(11-18(13-23)16-6-8-19(22)9-7-16)15(2)24(14)20-4-3-5-21(12-20)25(26)27/h3-12H,1-2H3