[(3R)-1-[1-[(2-methoxy-5-methoxycarbonyl-phenyl)methyl]-6-oxidanylidene-pyridazin-4-yl]pyrrolidin-3-yl]methylazanium

Systemtic Name: [(3R)-1-[1-[(2-methoxy-5-methoxycarbonyl-phenyl)methyl]-6-oxidanylidene-pyridazin-4-yl]pyrrolidin-3-yl]methylazanium Openeye Name: [(3R)-1-[1-[(2-methoxy-5-methoxycarbonyl-phenyl)methyl]-6-oxo-pyridazin-4-yl]pyrrolidin-3-yl]methylammonium CAS Name: [(3R)-1-[1-[(2-methoxy-5-methoxycarbonylphenyl)methyl]-6-oxo-4-pyridazinyl]-3-pyrrolidinyl]methylammonium IUPAC Name: [(3R)-1-[1-[(2-methoxy-5-methoxycarbonylphenyl)methyl]-6-oxopyridazin-4-yl]pyrrolidin-3-yl]methylazanium Traditional Name: [(3R)-1-[1-(5-carbomethoxy-2-methoxy-benzyl)-6-keto-pyridazin-4-yl]pyrrolidin-3-yl]methylammonium Formula: C19H25N4O4+ MolecularWeight: 373.4262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC)CN2C(=O)C=C(C=N2)N3CCC(C3)C[NH3+]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC)CN2C(=O)C=C(C=N2)N3CC[C@@H](C3)C[NH3+]

InChI

InChI=1S/C19H24N4O4/c1-26-17-4-3-14(19(25)27-2)7-15(17)12-23-18(24)8-16(10-21-23)22-6-5-13(9-20)11-22/h3-4,7-8,10,13H,5-6,9,11-12,20H2,1-2H3/p+1/t13-/m1/s1