1-(2-methoxyethyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-(2-methoxyethyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-(2-methoxyethyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-6-oxo-pyridazine-3-carboxamide CAS Name: 1-(2-methoxyethyl)-N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-6-oxo-3-pyridazinecarboxamide IUPAC Name: 1-(2-methoxyethyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-6-oxopyridazine-3-carboxamide Traditional Name: 6-keto-1-(2-methoxyethyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]pyridazine-3-carboxamide Formula: C21H29N4O4+ MolecularWeight: 401.47936

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C=CC(=N1)C(=O)NCC(C2=CC=CC=C2OC)[NH+]3CCCC3

Isomeric SMILES

COCCN1C(=O)C=CC(=N1)C(=O)NC[C@@H](C2=CC=CC=C2OC)[NH+]3CCCC3

InChI

InChI=1S/C21H28N4O4/c1-28-14-13-25-20(26)10-9-17(23-25)21(27)22-15-18(24-11-5-6-12-24)16-7-3-4-8-19(16)29-2/h3-4,7-10,18H,5-6,11-15H2,1-2H3,(H,22,27)/p+1/t18-/m0/s1