tert-butyl N-[4-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylamino]-4-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylamino]-4-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylamino]-4-oxo-butyl]carbamate CAS Name: N-[4-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylamino]-4-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylamino]-4-oxobutyl]carbamate Traditional Name: N-[4-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methylamino]-4-keto-butyl]carbamic acid tert-butyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)CCCNC(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CNC(=O)CCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H32N2O5/c1-6-26-17-11-15-10-14(2)27-18(15)12-16(17)13-23-19(24)8-7-9-22-20(25)28-21(3,4)5/h11-12,14H,6-10,13H2,1-5H3,(H,22,25)(H,23,24)/t14-/m0/s1