5-methyl-N-[3-oxidanylidene-3-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]propyl]-N-propyl-pyrazine-2-carboxamide

Systemtic Name: 5-methyl-N-[3-oxidanylidene-3-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]propyl]-N-propyl-pyrazine-2-carboxamide Openeye Name: N-[3-[(1-benzylpiperidin-1-ium-4-yl)amino]-3-oxo-propyl]-5-methyl-N-propyl-pyrazine-2-carboxamide CAS Name: 5-methyl-N-[3-oxo-3-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]propyl]-N-propyl-2-pyrazinecarboxamide IUPAC Name: N-[3-[(1-benzylpiperidin-1-ium-4-yl)amino]-3-oxopropyl]-5-methyl-N-propylpyrazine-2-carboxamide Traditional Name: N-[3-[(1-benzylpiperidin-1-ium-4-yl)amino]-3-keto-propyl]-5-methyl-N-propyl-pyrazinamide Formula: C24H34N5O2+ MolecularWeight: 424.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC(=O)NC1CC[NH+](CC1)CC2=CC=CC=C2)C(=O)C3=CN=C(C=N3)C

Isomeric SMILES

CCCN(CCC(=O)NC1CC[NH+](CC1)CC2=CC=CC=C2)C(=O)C3=CN=C(C=N3)C

InChI

InChI=1S/C24H33N5O2/c1-3-12-29(24(31)22-17-25-19(2)16-26-22)15-11-23(30)27-21-9-13-28(14-10-21)18-20-7-5-4-6-8-20/h4-8,16-17,21H,3,9-15,18H2,1-2H3,(H,27,30)/p+1