(3R)-6-(azepan-1-ylcarbonyl)-3-phenyl-3,4-dihydroisochromen-1-one

Systemtic Name: (3R)-6-(azepan-1-ylcarbonyl)-3-phenyl-3,4-dihydroisochromen-1-one Openeye Name: (3R)-6-(azepane-1-carbonyl)-3-phenyl-isochroman-1-one CAS Name: (3R)-6-[1-azepanyl(oxo)methyl]-3-phenyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3R)-6-(azepane-1-carbonyl)-3-phenyl-3,4-dihydroisochromen-1-one Traditional Name: (3R)-6-(azepane-1-carbonyl)-3-phenyl-isochroman-1-one Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)O[C@H](C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23NO3/c24-21(23-12-6-1-2-7-13-23)17-10-11-19-18(14-17)15-20(26-22(19)25)16-8-4-3-5-9-16/h3-5,8-11,14,20H,1-2,6-7,12-13,15H2/t20-/m1/s1