6-[(8-tert-butyl-5,5-dimethyl-6H-naphthalen-2-yl)-ethyl-amino]pyridine-3-carboxylic acid

Systemtic Name: 6-[(8-tert-butyl-5,5-dimethyl-6H-naphthalen-2-yl)-ethyl-amino]pyridine-3-carboxylic acid Openeye Name: 6-[(8-tert-butyl-5,5-dimethyl-6H-naphthalen-2-yl)-ethyl-amino]pyridine-3-carboxylic acid CAS Name: 6-[(8-tert-butyl-5,5-dimethyl-6H-naphthalen-2-yl)-ethylamino]-3-pyridinecarboxylic acid IUPAC Name: 6-[(8-tert-butyl-5,5-dimethyl-6H-naphthalen-2-yl)-ethylamino]pyridine-3-carboxylic acid Traditional Name: 6-[(8-tert-butyl-5,5-dimethyl-6H-naphthalen-2-yl)-ethyl-amino]nicotinic acid Formula: C24H30N2O2 MolecularWeight: 378.5072

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)C(CC=C2C(C)(C)C)(C)C)C3=NC=C(C=C3)C(=O)O

Isomeric SMILES

CCN(C1=CC2=C(C=C1)C(CC=C2C(C)(C)C)(C)C)C3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H30N2O2/c1-7-26(21-11-8-16(15-25-21)22(27)28)17-9-10-20-18(14-17)19(23(2,3)4)12-13-24(20,5)6/h8-12,14-15H,7,13H2,1-6H3,(H,27,28)