methyl 5-[[[2-(2-methoxyethoxycarbonyl)cyclohexen-1-yl]carbonyl-phenyl-amino]methyl]pyridine-3-carboxylate

Systemtic Name: methyl 5-[[[2-(2-methoxyethoxycarbonyl)cyclohexen-1-yl]carbonyl-phenyl-amino]methyl]pyridine-3-carboxylate Openeye Name: methyl 5-[(N-[2-(2-methoxyethoxycarbonyl)cyclohexene-1-carbonyl]anilino)methyl]pyridine-3-carboxylate CAS Name: 5-[(N-[[2-[2-methoxyethoxy(oxo)methyl]-1-cyclohexenyl]-oxomethyl]anilino)methyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(N-[2-(2-methoxyethoxycarbonyl)cyclohexene-1-carbonyl]anilino)methyl]pyridine-3-carboxylate Traditional Name: 5-[(N-[2-(2-methoxyethoxycarbonyl)cyclohexene-1-carbonyl]anilino)methyl]nicotinic acid methyl ester Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=C(CCCC1)C(=O)N(CC2=CN=CC(=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

COCCOC(=O)C1=C(CCCC1)C(=O)N(CC2=CN=CC(=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O6/c1-31-12-13-33-25(30)22-11-7-6-10-21(22)23(28)27(20-8-4-3-5-9-20)17-18-14-19(16-26-15-18)24(29)32-2/h3-5,8-9,14-16H,6-7,10-13,17H2,1-2H3