methyl 3-[[4-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-6-oxidanylidene-pyridazin-1-yl]methyl]-4-methoxy-benzoate

Systemtic Name: methyl 3-[[4-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-6-oxidanylidene-pyridazin-1-yl]methyl]-4-methoxy-benzoate Openeye Name: methyl 3-[[4-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-6-oxo-pyridazin-1-yl]methyl]-4-methoxy-benzoate CAS Name: 3-[[4-[(3R)-3-(aminomethyl)-1-pyrrolidinyl]-6-oxo-1-pyridazinyl]methyl]-4-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-[[4-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-6-oxopyridazin-1-yl]methyl]-4-methoxybenzoate Traditional Name: 3-[[4-[(3R)-3-(aminomethyl)pyrrolidino]-6-keto-pyridazin-1-yl]methyl]-4-methoxy-benzoic acid methyl ester Formula: C19H24N4O4 MolecularWeight: 372.41826

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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)CN

Isomeric SMILES

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

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/t13-/m1/s1