1-[[4-ethoxy-2-(phenylmethyl)-2H-chromen-3-yl]methyl]piperidin-1-ium

Systemtic Name: 1-[[4-ethoxy-2-(phenylmethyl)-2H-chromen-3-yl]methyl]piperidin-1-ium Openeye Name: 1-[(2-benzyl-4-ethoxy-2H-chromen-3-yl)methyl]piperidin-1-ium CAS Name: 1-[[4-ethoxy-2-(phenylmethyl)-2H-1-benzopyran-3-yl]methyl]piperidin-1-ium IUPAC Name: 1-[(2-benzyl-4-ethoxy-2H-chromen-3-yl)methyl]piperidin-1-ium Traditional Name: 1-[(2-benzyl-4-ethoxy-2H-chromen-3-yl)methyl]piperidin-1-ium Formula: C24H30NO2+ MolecularWeight: 364.5005

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(OC2=CC=CC=C21)CC3=CC=CC=C3)C[NH+]4CCCCC4

Isomeric SMILES

CCOC1=C(C(OC2=CC=CC=C21)CC3=CC=CC=C3)C[NH+]4CCCCC4

InChI

InChI=1S/C24H29NO2/c1-2-26-24-20-13-7-8-14-22(20)27-23(17-19-11-5-3-6-12-19)21(24)18-25-15-9-4-10-16-25/h3,5-8,11-14,23H,2,4,9-10,15-18H2,1H3/p+1