(1Z)-1-phenacylidenespiro[2,4-dihydroisoquinoline-3,4'-cyclohexane]-1'-carboxylic acid

Systemtic Name: (1Z)-1-phenacylidenespiro[2,4-dihydroisoquinoline-3,4'-cyclohexane]-1'-carboxylic acid Openeye Name: (1Z)-1-phenacylidenespiro[2,4-dihydroisoquinoline-3,4'-cyclohexane]-1'-carboxylic acid CAS Name: (1Z)-1-phenacylidene-1'-spiro[2,4-dihydroisoquinoline-3,4'-cyclohexane]carboxylic acid IUPAC Name: (1Z)-1-phenacylidenespiro[2,4-dihydroisoquinoline-3,4'-cyclohexane]-1'-carboxylic acid Traditional Name: (1Z)-1-phenacylidenespiro[2,4-dihydroisoquinoline-3,4'-cyclohexane]-1'-carboxylic acid Formula: C23H23NO3 MolecularWeight: 361.43362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1C(=O)O)CC3=CC=CC=C3C(=CC(=O)C4=CC=CC=C4)N2

Isomeric SMILES

C1CC2(CCC1C(=O)O)CC3=CC=CC=C3/C(=C/C(=O)C4=CC=CC=C4)/N2

InChI

InChI=1S/C23H23NO3/c25-21(16-6-2-1-3-7-16)14-20-19-9-5-4-8-18(19)15-23(24-20)12-10-17(11-13-23)22(26)27/h1-9,14,17,24H,10-13,15H2,(H,26,27)/b20-14-