N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-[(4-ethoxyphenyl)sulfonylamino]propanamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-[(4-ethoxyphenyl)sulfonylamino]propanamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-[(4-ethoxyphenyl)sulfonylamino]propanamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-[(4-ethoxyphenyl)sulfonylamino]propanamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-[(4-ethoxyphenyl)sulfonylamino]propanamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(p-phenetylsulfonylamino)propionamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC(C)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC(C)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C22H28N2O6S/c1-3-28-18-6-8-19(9-7-18)31(26,27)23-12-11-22(25)24-16(2)17-5-10-20-21(15-17)30-14-4-13-29-20/h5-10,15-16,23H,3-4,11-14H2,1-2H3,(H,24,25)