N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-[(4-methoxyphenyl)sulfonyl-methylamino]butanamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-[(4-methoxyphenyl)sulfonyl-methylamino]butanamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butyramide Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NCC1COC2=CC=CC=C2O1)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(CCCC(=O)NC[C@H]1COC2=CC=CC=C2O1)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26N2O6S/c1-23(30(25,26)18-11-9-16(27-2)10-12-18)13-5-8-21(24)22-14-17-15-28-19-6-3-4-7-20(19)29-17/h3-4,6-7,9-12,17H,5,8,13-15H2,1-2H3,(H,22,24)/t17-/m0/s1