2-(phenylmethyl)spiro[3H-isoquinoline-4,2'-cycloheptane]-1,1'-dione

Systemtic Name: 2-(phenylmethyl)spiro[3H-isoquinoline-4,2'-cycloheptane]-1,1'-dione Openeye Name: 2-benzylspiro[3H-isoquinoline-4,2'-cycloheptane]-1,1'-dione CAS Name: 2-(phenylmethyl)spiro[3H-isoquinoline-4,2'-cycloheptane]-1,1'-dione IUPAC Name: 2-benzylspiro[3H-isoquinoline-4,2'-cycloheptane]-1,1'-dione Traditional Name: 2-benzylspiro[3H-isoquinoline-4,2'-cycloheptane]-1,1'-quinone Formula: C22H23NO2 MolecularWeight: 333.42352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C2(CC1)CN(C(=O)C3=CC=CC=C23)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(=O)C2(CC1)CN(C(=O)C3=CC=CC=C23)CC4=CC=CC=C4

InChI

InChI=1S/C22H23NO2/c24-20-13-5-2-8-14-22(20)16-23(15-17-9-3-1-4-10-17)21(25)18-11-6-7-12-19(18)22/h1,3-4,6-7,9-12H,2,5,8,13-16H2