methyl (3S)-2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydrochromene-6-carboximidate

Systemtic Name: methyl (3S)-2,2-dimethyl-3-oxidanyl-4-(2-oxidanylidenepyrrolidin-1-yl)-3,4-dihydrochromene-6-carboximidate Openeye Name: methyl (3S)-3-hydroxy-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)chromane-6-carboximidate CAS Name: (3S)-3-hydroxy-2,2-dimethyl-4-(2-oxo-1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-6-carboximidic acid methyl ester IUPAC Name: methyl (3S)-3-hydroxy-2,2-dimethyl-4-(2-oxopyrrolidin-1-yl)-3,4-dihydrochromene-6-carboximidate Traditional Name: (3S)-3-hydroxy-4-(2-ketopyrrolidino)-2,2-dimethyl-chroman-6-carboximidic acid methyl ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C(=N)OC)N3CCCC3=O)O)C

Isomeric SMILES

CC1([C@H](C(C2=C(O1)C=CC(=C2)C(=N)OC)N3CCCC3=O)O)C

InChI

InChI=1S/C17H22N2O4/c1-17(2)15(21)14(19-8-4-5-13(19)20)11-9-10(16(18)22-3)6-7-12(11)23-17/h6-7,9,14-15,18,21H,4-5,8H2,1-3H3/t14?,15-/m0/s1