methyl 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-[2-(hydroxymethyl)pyrrolidin-1-yl]pyridazine-3-carboxylate

Systemtic Name: methyl 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-[2-(hydroxymethyl)pyrrolidin-1-yl]pyridazine-3-carboxylate Openeye Name: methyl 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-[2-(hydroxymethyl)pyrrolidin-1-yl]pyridazine-3-carboxylate CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-[2-(hydroxymethyl)-1-pyrrolidinyl]-3-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-[2-(hydroxymethyl)pyrrolidin-1-yl]pyridazine-3-carboxylate Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-(2-methylolpyrrolidino)pyridazine-3-carboxylic acid methyl ester Formula: C19H23ClN4O4 MolecularWeight: 406.86332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=CC(=NN=C2C(=O)OC)N3CCCC3CO)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=CC(=NN=C2C(=O)OC)N3CCCC3CO)Cl

InChI

InChI=1S/C19H23ClN4O4/c1-27-16-6-5-12(8-14(16)20)10-21-15-9-17(22-23-18(15)19(26)28-2)24-7-3-4-13(24)11-25/h5-6,8-9,13,25H,3-4,7,10-11H2,1-2H3,(H,21,22)