4-(4-but-2-ynoxyphenyl)sulfonylpiperidin-3-ol; methanamide; hydrochloride

Systemtic Name: 4-(4-but-2-ynoxyphenyl)sulfonylpiperidin-3-ol; methanamide; hydrochloride Openeye Name: 4-(4-but-2-ynoxyphenyl)sulfonylpiperidin-3-ol; formamide; hydrochloride CAS Name: 4-(4-but-2-ynoxyphenyl)sulfonyl-3-piperidinol; formamide; hydrochloride IUPAC Name: 4-(4-but-2-ynoxyphenyl)sulfonylpiperidin-3-ol; formamide; hydrochloride Traditional Name: 4-(4-but-2-ynoxyphenyl)sulfonylpiperidin-3-ol; formamide; hydrochloride Formula: C16H23ClN2O5S MolecularWeight: 390.88222

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C2CCNCC2O.C(=O)N.Cl

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)C2CCNCC2O.C(=O)N.Cl

InChI

InChI=1S/C15H19NO4S.CH3NO.ClH/c1-2-3-10-20-12-4-6-13(7-5-12)21(18,19)15-8-9-16-11-14(15)17;2-1-3;/h4-7,14-17H,8-11H2,1H3;1H,(H2,2,3);1H