3,4-dihydro-1H-isoquinolin-2-yl-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methanone Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H26N2O2/c1-16-6-7-20(25-16)15-22-11-8-18(9-12-22)21(24)23-13-10-17-4-2-3-5-19(17)14-23/h2-7,18H,8-15H2,1H3/p+1