ethyl 2-chloranyl-4-[(3-ethoxy-3-oxidanylidene-propyl)-heptan-4-yl-amino]-6-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 2-chloranyl-4-[(3-ethoxy-3-oxidanylidene-propyl)-heptan-4-yl-amino]-6-methyl-pyridine-3-carboxylate Openeye Name: ethyl 2-chloro-4-[(3-ethoxy-3-oxo-propyl)-(1-propylbutyl)amino]-6-methyl-pyridine-3-carboxylate CAS Name: 2-chloro-4-[(3-ethoxy-3-oxopropyl)-heptan-4-ylamino]-6-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-chloro-4-[(3-ethoxy-3-oxopropyl)-heptan-4-ylamino]-6-methylpyridine-3-carboxylate Traditional Name: 2-chloro-4-[(3-ethoxy-3-keto-propyl)-(1-propylbutyl)amino]-6-methyl-nicotinic acid ethyl ester Formula: C21H33ClN2O4 MolecularWeight: 412.95072

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)N(CCC(=O)OCC)C1=CC(=NC(=C1C(=O)OCC)Cl)C

Isomeric SMILES

CCCC(CCC)N(CCC(=O)OCC)C1=CC(=NC(=C1C(=O)OCC)Cl)C

InChI

InChI=1S/C21H33ClN2O4/c1-6-10-16(11-7-2)24(13-12-18(25)27-8-3)17-14-15(5)23-20(22)19(17)21(26)28-9-4/h14,16H,6-13H2,1-5H3