ethyl 2-methyl-6-[4-(phenylmethyl)piperazin-1-yl]carbonyl-pyridine-3-carboxylate

Systemtic Name: ethyl 2-methyl-6-[4-(phenylmethyl)piperazin-1-yl]carbonyl-pyridine-3-carboxylate Openeye Name: ethyl 6-(4-benzylpiperazine-1-carbonyl)-2-methyl-pyridine-3-carboxylate CAS Name: 2-methyl-6-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-benzylpiperazine-1-carbonyl)-2-methylpyridine-3-carboxylate Traditional Name: 6-(4-benzylpiperazine-1-carbonyl)-2-methyl-nicotinic acid ethyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C21H25N3O3/c1-3-27-21(26)18-9-10-19(22-16(18)2)20(25)24-13-11-23(12-14-24)15-17-7-5-4-6-8-17/h4-10H,3,11-15H2,1-2H3