tert-butyl N-[4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]-4-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]-4-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]-4-oxo-butyl]carbamate CAS Name: N-[4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylamino]-4-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylamino]-4-oxobutyl]carbamate Traditional Name: N-[4-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]-4-keto-butyl]carbamic acid tert-butyl ester Formula: C21H33N3O4 MolecularWeight: 391.50442

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)C(=O)CCCNC(=O)OC(C)(C)C

Isomeric SMILES

CCN1C[C@H](OC2=CC=CC=C21)CN(C)C(=O)CCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H33N3O4/c1-6-24-15-16(27-18-11-8-7-10-17(18)24)14-23(5)19(25)12-9-13-22-20(26)28-21(2,3)4/h7-8,10-11,16H,6,9,12-15H2,1-5H3,(H,22,26)/t16-/m1/s1