O3-ethyl O5-methyl 4-(2-chlorophenyl)-2-[2-[(N-cyano-N'-methyl-carbamimidoyl)amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-methyl 4-(2-chlorophenyl)-2-[2-[(N-cyano-N'-methyl-carbamimidoyl)amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-methyl 4-(2-chlorophenyl)-2-[2-[(N-cyano-N'-methyl-carbamimidoyl)amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-chlorophenyl)-2-[2-[[(cyanoamino)-methyliminomethyl]amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester IUPAC Name: 3-O-ethyl 5-O-methyl 4-(2-chlorophenyl)-2-[2-[(N-cyano-N'-methylcarbamimidoyl)amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-chlorophenyl)-2-[2-[(N-cyano-N'-methyl-amidino)amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester Formula: C23H28ClN5O5 MolecularWeight: 489.95192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCNC(=NC)NC#N

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCNC(=NC)NC#N

InChI

InChI=1S/C23H28ClN5O5/c1-5-34-22(31)20-17(12-33-11-10-27-23(26-3)28-13-25)29-14(2)18(21(30)32-4)19(20)15-8-6-7-9-16(15)24/h6-9,19,29H,5,10-12H2,1-4H3,(H2,26,27,28)