tert-butyl 4-[(1S)-2-azanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(1S)-2-azanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(1S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperazine-1-carboxylate CAS Name: 4-[(1S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[(1S)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H29N3O4 MolecularWeight: 363.45126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(CN)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)[C@H](CN)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H29N3O4/c1-19(2,3)26-18(23)22-8-6-21(7-9-22)15(13-20)14-4-5-16-17(12-14)25-11-10-24-16/h4-5,12,15H,6-11,13,20H2,1-3H3/t15-/m1/s1