tert-butyl 2-[[4-methyl-2-(1-phenylethenyl)phenoxy]methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[4-methyl-2-(1-phenylethenyl)phenoxy]methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[4-methyl-2-(1-phenylvinyl)phenoxy]methyl]pyrrolidine-1-carboxylate CAS Name: 2-[[4-methyl-2-(1-phenylethenyl)phenoxy]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-methyl-2-(1-phenylethenyl)phenoxy]methyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[4-methyl-2-(1-phenylvinyl)phenoxy]methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H31NO3 MolecularWeight: 393.51854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2CCCN2C(=O)OC(C)(C)C)C(=C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2CCCN2C(=O)OC(C)(C)C)C(=C)C3=CC=CC=C3

InChI

InChI=1S/C25H31NO3/c1-18-13-14-23(22(16-18)19(2)20-10-7-6-8-11-20)28-17-21-12-9-15-26(21)24(27)29-25(3,4)5/h6-8,10-11,13-14,16,21H,2,9,12,15,17H2,1,3-5H3