2-(3-bromophenyl)-3-(3-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enenitrile

Systemtic Name: 2-(3-bromophenyl)-3-(3-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enenitrile Openeye Name: 2-(3-bromophenyl)-3-(3-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enenitrile CAS Name: 2-(3-bromophenyl)-3-[3-methyl-4-(1-pyrrolidinyl)phenyl]-2-propenenitrile IUPAC Name: 2-(3-bromophenyl)-3-(3-methyl-4-pyrrolidin-1-ylphenyl)prop-2-enenitrile Traditional Name: 2-(3-bromophenyl)-3-(3-methyl-4-pyrrolidino-phenyl)acrylonitrile Formula: C20H19BrN2 MolecularWeight: 367.28226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=C(C#N)C2=CC(=CC=C2)Br)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C=C(C#N)C2=CC(=CC=C2)Br)N3CCCC3

InChI

InChI=1S/C20H19BrN2/c1-15-11-16(7-8-20(15)23-9-2-3-10-23)12-18(14-22)17-5-4-6-19(21)13-17/h4-8,11-13H,2-3,9-10H2,1H3