ethyl 4-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-methyl-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl]piperazine-1-carboxylate Traditional Name: 4-[(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-1-methyl-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)[C@H](C)C(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H25N3O5/c1-3-24-18(23)21-8-6-20(7-9-21)13(2)17(22)19-14-4-5-15-16(12-14)26-11-10-25-15/h4-5,12-13H,3,6-11H2,1-2H3,(H,19,22)/t13-/m1/s1