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

Systemtic Name: 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]-N-propyl-pyrazine-2-carboxamide CAS Name: 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]-N-propylpyrazine-2-carboxamide Traditional Name: N-[3-[(1-benzylpiperidin-1-ium-4-yl)amino]-3-keto-propyl]-N-propyl-pyrazinamide Formula: C23H32N5O2+ MolecularWeight: 410.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5O2/c1-2-13-28(23(30)21-17-24-11-12-25-21)16-10-22(29)26-20-8-14-27(15-9-20)18-19-6-4-3-5-7-19/h3-7,11-12,17,20H,2,8-10,13-16,18H2,1H3,(H,26,29)/p+1