3-[2-[(3-methyl-4-pyrrolidin-1-ylcarbonyl-phenyl)amino]ethyl]-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-[2-[(3-methyl-4-pyrrolidin-1-ylcarbonyl-phenyl)amino]ethyl]-4-oxidanyl-benzenecarbonitrile Openeye Name: 4-hydroxy-3-[2-[3-methyl-4-(pyrrolidine-1-carbonyl)anilino]ethyl]benzonitrile CAS Name: 4-hydroxy-3-[2-[3-methyl-4-[oxo(1-pyrrolidinyl)methyl]anilino]ethyl]benzonitrile IUPAC Name: 4-hydroxy-3-[2-[3-methyl-4-(pyrrolidine-1-carbonyl)anilino]ethyl]benzonitrile Traditional Name: 4-hydroxy-3-[2-[3-methyl-4-(pyrrolidine-1-carbonyl)anilino]ethyl]benzonitrile Formula: C21H23N3O2 MolecularWeight: 349.42622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NCCC2=C(C=CC(=C2)C#N)O)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)NCCC2=C(C=CC(=C2)C#N)O)C(=O)N3CCCC3

InChI

InChI=1S/C21H23N3O2/c1-15-12-18(5-6-19(15)21(26)24-10-2-3-11-24)23-9-8-17-13-16(14-22)4-7-20(17)25/h4-7,12-13,23,25H,2-3,8-11H2,1H3