2-(5-bromanyl-2-phenylmethoxy-phenyl)-1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-2-carbonitrile

Systemtic Name: 2-(5-bromanyl-2-phenylmethoxy-phenyl)-1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-2-carbonitrile Openeye Name: 2-(2-benzyloxy-5-bromo-phenyl)-1-(o-tolyl)-5-oxo-pyrrolidine-2-carbonitrile CAS Name: 2-(5-bromo-2-phenylmethoxyphenyl)-1-(2-methylphenyl)-5-oxo-2-pyrrolidinecarbonitrile IUPAC Name: 2-(5-bromo-2-phenylmethoxyphenyl)-1-(2-methylphenyl)-5-oxopyrrolidine-2-carbonitrile Traditional Name: 2-(2-benzoxy-5-bromo-phenyl)-5-keto-1-(o-tolyl)pyrrolidine-2-carbonitrile Formula: C25H21BrN2O2 MolecularWeight: 461.35044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)CCC2(C#N)C3=C(C=CC(=C3)Br)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)CCC2(C#N)C3=C(C=CC(=C3)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C25H21BrN2O2/c1-18-7-5-6-10-22(18)28-24(29)13-14-25(28,17-27)21-15-20(26)11-12-23(21)30-16-19-8-3-2-4-9-19/h2-12,15H,13-14,16H2,1H3