2-[(phenylmethyl)-propan-2-yl-amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[(phenylmethyl)-propan-2-yl-amino]pyridine-3-carboxylic acid Openeye Name: 2-[benzyl(isopropyl)amino]pyridine-3-carboxylic acid CAS Name: 2-[(phenylmethyl)-propan-2-ylamino]-3-pyridinecarboxylic acid IUPAC Name: 2-[benzyl(propan-2-yl)amino]pyridine-3-carboxylic acid Traditional Name: 2-[benzyl(isopropyl)amino]nicotinic acid Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C16H18N2O2/c1-12(2)18(11-13-7-4-3-5-8-13)15-14(16(19)20)9-6-10-17-15/h3-10,12H,11H2,1-2H3,(H,19,20)