quinolin-2-ylmethyl N-[6-[3-(2-azanylethyl)oxiran-2-yl]-2-methyl-4-oxidanylidene-hexyl]carbamate

Systemtic Name: quinolin-2-ylmethyl N-[6-[3-(2-azanylethyl)oxiran-2-yl]-2-methyl-4-oxidanylidene-hexyl]carbamate Openeye Name: 2-quinolylmethyl N-[6-[3-(2-aminoethyl)oxiran-2-yl]-2-methyl-4-oxo-hexyl]carbamate CAS Name: N-[6-[3-(2-aminoethyl)-2-oxiranyl]-2-methyl-4-oxohexyl]carbamic acid 2-quinolinylmethyl ester IUPAC Name: quinolin-2-ylmethyl N-[6-[3-(2-aminoethyl)oxiran-2-yl]-2-methyl-4-oxohexyl]carbamate Traditional Name: N-[6-[3-(2-aminoethyl)oxiran-2-yl]-4-keto-2-methyl-hexyl]carbamic acid 2-quinolylmethyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)CCC1C(O1)CCN)CNC(=O)OCC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(CC(=O)CCC1C(O1)CCN)CNC(=O)OCC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H29N3O4/c1-15(12-18(26)8-9-20-21(29-20)10-11-23)13-24-22(27)28-14-17-7-6-16-4-2-3-5-19(16)25-17/h2-7,15,20-21H,8-14,23H2,1H3,(H,24,27)