[4-(2-azanylethoxy)-3-methoxy-phenyl]methyl-octyl-carbamothioic S-acid

Systemtic Name: [4-(2-azanylethoxy)-3-methoxy-phenyl]methyl-octyl-carbamothioic S-acid Openeye Name: [4-(2-aminoethoxy)-3-methoxy-phenyl]methyl-octyl-carbamothioic S-acid CAS Name: [4-(2-aminoethoxy)-3-methoxyphenyl]methyl-octylcarbamothioic S-acid IUPAC Name: [4-(2-aminoethoxy)-3-methoxyphenyl]methyl-octylcarbamothioic S-acid Traditional Name: [4-(2-aminoethoxy)-3-methoxy-benzyl]-octyl-thiocarbamic S-acid Formula: C19H32N2O3S MolecularWeight: 368.53398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CC1=CC(=C(C=C1)OCCN)OC)C(=O)S

Isomeric SMILES

CCCCCCCCN(CC1=CC(=C(C=C1)OCCN)OC)C(=O)S

InChI

InChI=1S/C19H32N2O3S/c1-3-4-5-6-7-8-12-21(19(22)25)15-16-9-10-17(24-13-11-20)18(14-16)23-2/h9-10,14H,3-8,11-13,15,20H2,1-2H3,(H,22,25)