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

Systemtic Name: tert-butyl N-[5-methyl-4-oxidanylidene-2-[(2S)-2-(pyridin-2-ylmethylcarbamoyl)piperidin-1-yl]-3,1-benzoxazin-6-yl]carbamate Openeye Name: tert-butyl N-[5-methyl-4-oxo-2-[(2S)-2-(2-pyridylmethylcarbamoyl)-1-piperidyl]-3,1-benzoxazin-6-yl]carbamate CAS Name: N-[5-methyl-4-oxo-2-[(2S)-2-[oxo-(2-pyridinylmethylamino)methyl]-1-piperidinyl]-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-methyl-4-oxo-2-[(2S)-2-(pyridin-2-ylmethylcarbamoyl)piperidin-1-yl]-3,1-benzoxazin-6-yl]carbamate Traditional Name: N-[4-keto-5-methyl-2-[(2S)-2-(2-pyridylmethylcarbamoyl)piperidino]-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester Formula: C26H31N5O5 MolecularWeight: 493.55484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCCCC3C(=O)NCC4=CC=CC=N4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N3CCCC[C@H]3C(=O)NCC4=CC=CC=N4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H31N5O5/c1-16-18(30-25(34)36-26(2,3)4)11-12-19-21(16)23(33)35-24(29-19)31-14-8-6-10-20(31)22(32)28-15-17-9-5-7-13-27-17/h5,7,9,11-13,20H,6,8,10,14-15H2,1-4H3,(H,28,32)(H,30,34)/t20-/m0/s1