3-[1-(2,4-dimethylphenyl)pyrrol-2-yl]-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-[1-(2,4-dimethylphenyl)pyrrol-2-yl]-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-[1-(2,4-dimethylphenyl)pyrrol-2-yl]-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-[1-(2,4-dimethylphenyl)-2-pyrrolyl]-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-[1-(2,4-dimethylphenyl)pyrrol-2-yl]-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-[1-(2,4-dimethylphenyl)pyrrol-2-yl]-2-(3-nitrophenyl)acrylonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC=C2C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC=C2C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H17N3O2/c1-15-8-9-21(16(2)11-15)23-10-4-7-19(23)13-18(14-22)17-5-3-6-20(12-17)24(25)26/h3-13H,1-2H3