3-pyrrolidin-1-ylbutan-2-yl 2-cyclohex-2-en-1-yl-2-phenyl-ethanoate

Systemtic Name: 3-pyrrolidin-1-ylbutan-2-yl 2-cyclohex-2-en-1-yl-2-phenyl-ethanoate Openeye Name: (1-methyl-2-pyrrolidin-1-yl-propyl) 2-cyclohex-2-en-1-yl-2-phenyl-acetate CAS Name: 2-(1-cyclohex-2-enyl)-2-phenylacetic acid 3-(1-pyrrolidinyl)butan-2-yl ester IUPAC Name: 3-pyrrolidin-1-ylbutan-2-yl 2-cyclohex-2-en-1-yl-2-phenylacetate Traditional Name: 2-cyclohex-2-en-1-yl-2-phenyl-acetic acid (1-methyl-2-pyrrolidino-propyl) ester Formula: C22H31NO2 MolecularWeight: 341.48704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)OC(=O)C(C1CCCC=C1)C2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CC(C(C)OC(=O)C(C1CCCC=C1)C2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C22H31NO2/c1-17(23-15-9-10-16-23)18(2)25-22(24)21(19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3,5-7,11-13,17-18,20-21H,4,8-10,14-16H2,1-2H3