naphthalen-2-yl 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]ethanoate

Systemtic Name: naphthalen-2-yl 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]ethanoate Openeye Name: 2-naphthyl 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetate CAS Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetic acid 2-naphthalenyl ester IUPAC Name: naphthalen-2-yl 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetate Traditional Name: 2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]acetic acid 2-naphthyl ester Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC1=CC2=CC=CC=C2C=C1)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(CC(=O)OC1=CC2=CC=CC=C2C=C1)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H21NO6S/c1-23(15-22(24)29-18-8-7-16-5-2-3-6-17(16)13-18)30(25,26)19-9-10-20-21(14-19)28-12-4-11-27-20/h2-3,5-10,13-14H,4,11-12,15H2,1H3