1-[(3R,4S)-7-methoxy-2,2-dimethyl-3-oxidanyl-4-pyrrolidin-1-yl-3,4-dihydrochromen-6-yl]ethanone

Systemtic Name: 1-[(3R,4S)-7-methoxy-2,2-dimethyl-3-oxidanyl-4-pyrrolidin-1-yl-3,4-dihydrochromen-6-yl]ethanone Openeye Name: 1-[(3R,4S)-3-hydroxy-7-methoxy-2,2-dimethyl-4-pyrrolidin-1-yl-chroman-6-yl]ethanone CAS Name: 1-[(3R,4S)-3-hydroxy-7-methoxy-2,2-dimethyl-4-(1-pyrrolidinyl)-3,4-dihydro-2H-1-benzopyran-6-yl]ethanone IUPAC Name: 1-[(3R,4S)-3-hydroxy-7-methoxy-2,2-dimethyl-4-pyrrolidin-1-yl-3,4-dihydrochromen-6-yl]ethanone Traditional Name: 1-[(3R,4S)-3-hydroxy-7-methoxy-2,2-dimethyl-4-pyrrolidino-chroman-6-yl]ethanone Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1OC)OC(C(C2N3CCCC3)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1OC)OC([C@@H]([C@H]2N3CCCC3)O)(C)C

InChI

InChI=1S/C18H25NO4/c1-11(20)12-9-13-15(10-14(12)22-4)23-18(2,3)17(21)16(13)19-7-5-6-8-19/h9-10,16-17,21H,5-8H2,1-4H3/t16-,17+/m0/s1