[1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Openeye Name: 1-(benzylcarbamoyl)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid [1-oxo-1-[(phenylmethyl)amino]butan-2-yl] ester IUPAC Name: [1-(benzylamino)-1-oxobutan-2-yl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-carboxylic acid 1-(benzylcarbamoyl)propyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)OC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H21NO5/c1-2-16(19(22)21-13-14-6-4-3-5-7-14)26-20(23)15-8-9-17-18(12-15)25-11-10-24-17/h3-9,12,16H,2,10-11,13H2,1H3,(H,21,22)