4-[2-[(8E)-8-ethoxyimino-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]ethynyl]benzoic acid

Systemtic Name: 4-[2-[(8E)-8-ethoxyimino-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]ethynyl]benzoic acid Openeye Name: 4-[2-[(4E)-4-ethoxyimino-1,1-dimethyl-tetralin-6-yl]ethynyl]benzoic acid CAS Name: 4-[2-[(8E)-8-ethoxyimino-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]ethynyl]benzoic acid IUPAC Name: 4-[2-[(8E)-8-ethoxyimino-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]ethynyl]benzoic acid Traditional Name: 4-[2-[(4E)-4-ethyloximino-1,1-dimethyl-tetralin-6-yl]ethynyl]benzoic acid Formula: C23H23NO3 MolecularWeight: 361.43362

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C1CCC(C2=C1C=C(C=C2)C#CC3=CC=C(C=C3)C(=O)O)(C)C

Isomeric SMILES

CCO/N=C/1\CCC(C2=C1C=C(C=C2)C#CC3=CC=C(C=C3)C(=O)O)(C)C

InChI

InChI=1S/C23H23NO3/c1-4-27-24-21-13-14-23(2,3)20-12-9-17(15-19(20)21)6-5-16-7-10-18(11-8-16)22(25)26/h7-12,15H,4,13-14H2,1-3H3,(H,25,26)/b24-21+