ethyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]propanoate CAS Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]propanoate Traditional Name: 3-[benzyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]propionic acid ethyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H23NO6S/c1-2-25-20(22)10-11-21(15-16-6-4-3-5-7-16)28(23,24)17-8-9-18-19(14-17)27-13-12-26-18/h3-9,14H,2,10-13,15H2,1H3