tert-butyl 2-azanyl-2-(3-azanyl-2-methyl-4H-1,4-benzoxazin-6-yl)-3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: tert-butyl 2-azanyl-2-(3-azanyl-2-methyl-4H-1,4-benzoxazin-6-yl)-3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: tert-butyl 2-amino-2-(3-amino-2-methyl-4H-1,4-benzoxazin-6-yl)-3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 2-amino-2-(3-amino-2-methyl-4H-1,4-benzoxazin-6-yl)-3-(1,3-benzodioxol-5-yl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-2-(3-amino-2-methyl-4H-1,4-benzoxazin-6-yl)-3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 2-amino-2-(3-amino-2-methyl-4H-1,4-benzoxazin-6-yl)-3-(1,3-benzodioxol-5-yl)propionic acid tert-butyl ester Formula: C23H27N3O5 MolecularWeight: 425.47758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C(O1)C=CC(=C2)C(CC3=CC4=C(C=C3)OCO4)(C(=O)OC(C)(C)C)N)N

Isomeric SMILES

CC1=C(NC2=C(O1)C=CC(=C2)C(CC3=CC4=C(C=C3)OCO4)(C(=O)OC(C)(C)C)N)N

InChI

InChI=1S/C23H27N3O5/c1-13-20(24)26-16-10-15(6-8-17(16)30-13)23(25,21(27)31-22(2,3)4)11-14-5-7-18-19(9-14)29-12-28-18/h5-10,26H,11-12,24-25H2,1-4H3