tert-butyl N-[2-(4-ethanoylpiperazin-1-yl)-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl]carbamate

Systemtic Name: tert-butyl N-[2-(4-ethanoylpiperazin-1-yl)-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl]carbamate Openeye Name: tert-butyl N-[2-(4-acetylpiperazin-1-yl)-5-methyl-4-oxo-3,1-benzoxazin-6-yl]carbamate CAS Name: N-[2-(4-acetyl-1-piperazinyl)-5-methyl-4-oxo-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(4-acetylpiperazin-1-yl)-5-methyl-4-oxo-3,1-benzoxazin-6-yl]carbamate Traditional Name: N-[2-(4-acetylpiperazino)-4-keto-5-methyl-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester Formula: C20H26N4O5 MolecularWeight: 402.44424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCN(CC3)C(=O)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCN(CC3)C(=O)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H26N4O5/c1-12-14(22-19(27)29-20(3,4)5)6-7-15-16(12)17(26)28-18(21-15)24-10-8-23(9-11-24)13(2)25/h6-7H,8-11H2,1-5H3,(H,22,27)