N-(furan-2-ylmethyl)-2-methyl-N-[3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-3-oxidanylidene-propyl]furan-3-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-2-methyl-N-[3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-3-oxidanylidene-propyl]furan-3-carboxamide Openeye Name: N-(2-furylmethyl)-2-methyl-N-[3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-3-oxo-propyl]furan-3-carboxamide CAS Name: N-(2-furanylmethyl)-2-methyl-N-[3-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-3-oxopropyl]-3-furancarboxamide IUPAC Name: N-(furan-2-ylmethyl)-2-methyl-N-[3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-3-oxopropyl]furan-3-carboxamide Traditional Name: N-(2-furfuryl)-N-[3-keto-3-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]propyl]-2-methyl-3-furamide Formula: C23H34N3O4+ MolecularWeight: 416.53376

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)CCN(CC2=CC=CO2)C(=O)C3=C(OC=C3)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)CCN(CC2=CC=CO2)C(=O)C3=C(OC=C3)C

InChI

InChI=1S/C23H33N3O4/c1-18-7-3-4-12-25(18)13-6-11-24-22(27)9-14-26(17-20-8-5-15-30-20)23(28)21-10-16-29-19(21)2/h5,8,10,15-16,18H,3-4,6-7,9,11-14,17H2,1-2H3,(H,24,27)/p+1/t18-/m0/s1