tert-butyl 4-[(1R)-2-azanyl-1-(3-methylphenyl)ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(1R)-2-azanyl-1-(3-methylphenyl)ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(1R)-2-amino-1-(m-tolyl)ethyl]piperazine-1-carboxylate CAS Name: 4-[(1R)-2-amino-1-(3-methylphenyl)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1R)-2-amino-1-(3-methylphenyl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[(1R)-2-amino-1-(m-tolyl)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C18H29N3O2 MolecularWeight: 319.44176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CN)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)[C@H](CN)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H29N3O2/c1-14-6-5-7-15(12-14)16(13-19)20-8-10-21(11-9-20)17(22)23-18(2,3)4/h5-7,12,16H,8-11,13,19H2,1-4H3/t16-/m0/s1