methyl 5-[4-[(2,2-dimethylcyclopentyl)methylcarbamoyl]phenyl]pyridine-3-carboxylate

Systemtic Name: methyl 5-[4-[(2,2-dimethylcyclopentyl)methylcarbamoyl]phenyl]pyridine-3-carboxylate Openeye Name: methyl 5-[4-[(2,2-dimethylcyclopentyl)methylcarbamoyl]phenyl]pyridine-3-carboxylate CAS Name: 5-[4-[[(2,2-dimethylcyclopentyl)methylamino]-oxomethyl]phenyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-[(2,2-dimethylcyclopentyl)methylcarbamoyl]phenyl]pyridine-3-carboxylate Traditional Name: 5-[4-[(2,2-dimethylcyclopentyl)methylcarbamoyl]phenyl]nicotinic acid methyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC1CNC(=O)C2=CC=C(C=C2)C3=CC(=CN=C3)C(=O)OC)C

Isomeric SMILES

CC1(CCCC1CNC(=O)C2=CC=C(C=C2)C3=CC(=CN=C3)C(=O)OC)C

InChI

InChI=1S/C22H26N2O3/c1-22(2)10-4-5-19(22)14-24-20(25)16-8-6-15(7-9-16)17-11-18(13-23-12-17)21(26)27-3/h6-9,11-13,19H,4-5,10,14H2,1-3H3,(H,24,25)