(3S,4R)-2,2-dimethyl-3-oxidanyl-4-piperidin-1-yl-3,4-dihydrochromene-6-carboxamide; methanesulfonic acid

Systemtic Name: (3S,4R)-2,2-dimethyl-3-oxidanyl-4-piperidin-1-yl-3,4-dihydrochromene-6-carboxamide; methanesulfonic acid Openeye Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-(1-piperidyl)chromane-6-carboxamide; methanesulfonic acid CAS Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-(1-piperidinyl)-3,4-dihydro-2H-1-benzopyran-6-carboxamide; methanesulfonic acid IUPAC Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-piperidin-1-yl-3,4-dihydrochromene-6-carboxamide; methanesulfonic acid Traditional Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-piperidino-chroman-6-carboxamide; mesylic acid Formula: C18H28N2O6S MolecularWeight: 400.48972

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C(=O)N)N3CCCCC3)O)C.CS(=O)(=O)O

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C(=O)N)N3CCCCC3)O)C.CS(=O)(=O)O

InChI

InChI=1S/C17H24N2O3.CH4O3S/c1-17(2)15(20)14(19-8-4-3-5-9-19)12-10-11(16(18)21)6-7-13(12)22-17;1-5(2,3)4/h6-7,10,14-15,20H,3-5,8-9H2,1-2H3,(H2,18,21);1H3,(H,2,3,4)/t14-,15+;/m1./s1