2-(1-adamantylmethyl)-5-naphthalen-2-yl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 2-(1-adamantylmethyl)-5-naphthalen-2-yl-1H-pyrrole-3-carboxylic acid Openeye Name: 2-(1-adamantylmethyl)-5-(2-naphthyl)-1H-pyrrole-3-carboxylic acid CAS Name: 2-(1-adamantylmethyl)-5-(2-naphthalenyl)-1H-pyrrole-3-carboxylic acid IUPAC Name: 2-(1-adamantylmethyl)-5-naphthalen-2-yl-1H-pyrrole-3-carboxylic acid Traditional Name: 2-(1-adamantylmethyl)-5-(2-naphthyl)-1H-pyrrole-3-carboxylic acid Formula: C26H27NO2 MolecularWeight: 385.49808

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC4=C(C=C(N4)C5=CC6=CC=CC=C6C=C5)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC4=C(C=C(N4)C5=CC6=CC=CC=C6C=C5)C(=O)O

InChI

InChI=1S/C26H27NO2/c28-25(29)22-11-23(21-6-5-19-3-1-2-4-20(19)10-21)27-24(22)15-26-12-16-7-17(13-26)9-18(8-16)14-26/h1-6,10-11,16-18,27H,7-9,12-15H2,(H,28,29)