3-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[1-[(8-methoxy-2H-1-benzopyran-3-yl)methyl]-4-piperidin-1-iumyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[1-[(8-methoxy-2H-chromen-3-yl)methyl]piperidin-1-ium-4-yl]-1-pyrrolidino-propan-1-one Formula: C23H33N2O3+ MolecularWeight: 385.51972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OCC(=C2)C[NH+]3CCC(CC3)CCC(=O)N4CCCC4

Isomeric SMILES

COC1=CC=CC2=C1OCC(=C2)C[NH+]3CCC(CC3)CCC(=O)N4CCCC4

InChI

InChI=1S/C23H32N2O3/c1-27-21-6-4-5-20-15-19(17-28-23(20)21)16-24-13-9-18(10-14-24)7-8-22(26)25-11-2-3-12-25/h4-6,15,18H,2-3,7-14,16-17H2,1H3/p+1