3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile CAS Name: 3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-[oxo(1-pyrrolidinyl)methyl]-2-propenenitrile IUPAC Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile Traditional Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-(pyrrolidine-1-carbonyl)acrylonitrile Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=C(C#N)C(=O)N3CCCC3

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=C(C#N)C(=O)N3CCCC3

InChI

InChI=1S/C23H25N3O/c1-2-25(18-20-8-4-3-5-9-20)22-12-10-19(11-13-22)16-21(17-24)23(27)26-14-6-7-15-26/h3-5,8-13,16H,2,6-7,14-15,18H2,1H3