6-[[(1S,5R)-2-azanyl-6-bicyclo[3.3.1]nonanyl]oxy]-7-methyl-2H-isoquinolin-1-one

Systemtic Name: 6-[[(1S,5R)-2-azanyl-6-bicyclo[3.3.1]nonanyl]oxy]-7-methyl-2H-isoquinolin-1-one Openeye Name: 6-[[(1S,5R)-2-amino-6-bicyclo[3.3.1]nonanyl]oxy]-7-methyl-2H-isoquinolin-1-one CAS Name: 6-[[(1S,5R)-2-amino-6-bicyclo[3.3.1]nonanyl]oxy]-7-methyl-2H-isoquinolin-1-one IUPAC Name: 6-[[(1S,5R)-2-amino-6-bicyclo[3.3.1]nonanyl]oxy]-7-methyl-2H-isoquinolin-1-one Traditional Name: 6-[[(1S,5R)-2-amino-6-bicyclo[3.3.1]nonanyl]oxy]-7-methyl-isocarbostyril Formula: C19H24N2O2 MolecularWeight: 312.40606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CNC(=O)C2=C1)OC3CCC4CC3CCC4N

Isomeric SMILES

CC1=C(C=C2C=CNC(=O)C2=C1)OC3CC[C@H]4C[C@H]3CCC4N

InChI

InChI=1S/C19H24N2O2/c1-11-8-15-12(6-7-21-19(15)22)10-18(11)23-17-5-3-13-9-14(17)2-4-16(13)20/h6-8,10,13-14,16-17H,2-5,9,20H2,1H3,(H,21,22)/t13-,14+,16?,17?/m0/s1