(4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl) pyridine-4-carboxylate

Systemtic Name: (4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl) pyridine-4-carboxylate Openeye Name: (1-benzyloxycarbonyl-3-methyl-butyl) pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid (4-methyl-1-oxo-1-phenylmethoxypentan-2-yl) ester IUPAC Name: (4-methyl-1-oxo-1-phenylmethoxypentan-2-yl) pyridine-4-carboxylate Traditional Name: isonicotinic acid (1-carbobenzoxy-3-methyl-butyl) ester Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)OC(=O)C2=CC=NC=C2

Isomeric SMILES

CC(C)CC(C(=O)OCC1=CC=CC=C1)OC(=O)C2=CC=NC=C2

InChI

InChI=1S/C19H21NO4/c1-14(2)12-17(24-18(21)16-8-10-20-11-9-16)19(22)23-13-15-6-4-3-5-7-15/h3-11,14,17H,12-13H2,1-2H3