4-[2-[5-(cyclopropylmethylamino)-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl]ethynyl]benzoic acid

Systemtic Name: 4-[2-[5-(cyclopropylmethylamino)-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl]ethynyl]benzoic acid Openeye Name: 4-[2-[1-(cyclopropylmethylamino)-4,4-dimethyl-tetralin-6-yl]ethynyl]benzoic acid CAS Name: 4-[2-[5-(cyclopropylmethylamino)-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl]ethynyl]benzoic acid IUPAC Name: 4-[2-[5-(cyclopropylmethylamino)-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl]ethynyl]benzoic acid Traditional Name: 4-[2-[1-(cyclopropylmethylamino)-4,4-dimethyl-tetralin-6-yl]ethynyl]benzoic acid Formula: C25H27NO2 MolecularWeight: 373.48738

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=C(C=C2)C#CC3=CC=C(C=C3)C(=O)O)NCC4CC4)C

Isomeric SMILES

CC1(CCC(C2=C1C=C(C=C2)C#CC3=CC=C(C=C3)C(=O)O)NCC4CC4)C

InChI

InChI=1S/C25H27NO2/c1-25(2)14-13-23(26-16-19-5-6-19)21-12-9-18(15-22(21)25)4-3-17-7-10-20(11-8-17)24(27)28/h7-12,15,19,23,26H,5-6,13-14,16H2,1-2H3,(H,27,28)