quinolin-2-ylmethyl N-[1-[3-(2-azanylethyl)oxiran-2-yl]-5-methyl-3-oxidanylidene-heptan-2-yl]carbamate

Systemtic Name: quinolin-2-ylmethyl N-[1-[3-(2-azanylethyl)oxiran-2-yl]-5-methyl-3-oxidanylidene-heptan-2-yl]carbamate Openeye Name: 2-quinolylmethyl N-[1-[[3-(2-aminoethyl)oxiran-2-yl]methyl]-4-methyl-2-oxo-hexyl]carbamate CAS Name: N-[1-[3-(2-aminoethyl)-2-oxiranyl]-5-methyl-3-oxoheptan-2-yl]carbamic acid 2-quinolinylmethyl ester IUPAC Name: quinolin-2-ylmethyl N-[1-[3-(2-aminoethyl)oxiran-2-yl]-5-methyl-3-oxoheptan-2-yl]carbamate Traditional Name: N-[1-[[3-(2-aminoethyl)oxiran-2-yl]methyl]-2-keto-4-methyl-hexyl]carbamic acid 2-quinolylmethyl ester Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)C(CC1C(O1)CCN)NC(=O)OCC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(C)CC(=O)C(CC1C(O1)CCN)NC(=O)OCC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H31N3O4/c1-3-15(2)12-20(27)19(13-22-21(30-22)10-11-24)26-23(28)29-14-17-9-8-16-6-4-5-7-18(16)25-17/h4-9,15,19,21-22H,3,10-14,24H2,1-2H3,(H,26,28)