6-(4-methylphenyl)-N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-2H-chromene-3-carboxamide iodide

Systemtic Name: 6-(4-methylphenyl)-N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-2H-chromene-3-carboxamide iodide Openeye Name: N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-6-(p-tolyl)-2H-chromene-3-carboxamide iodide CAS Name: 6-(4-methylphenyl)-N-[4-[(1-methyl-1-piperidin-1-iumyl)methyl]phenyl]-2H-1-benzopyran-3-carboxamide iodide IUPAC Name: 6-(4-methylphenyl)-N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-2H-chromene-3-carboxamide iodide Traditional Name: N-[4-[(1-methylpiperidin-1-ium-1-yl)methyl]phenyl]-6-(p-tolyl)-2H-chromene-3-carboxamide iodide Formula: C30H33IN2O2 MolecularWeight: 580.49969

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCC(=C3)C(=O)NC4=CC=C(C=C4)C[N+]5(CCCCC5)C.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCC(=C3)C(=O)NC4=CC=C(C=C4)C[N+]5(CCCCC5)C.[I-]

InChI

InChI=1S/C30H32N2O2.HI/c1-22-6-10-24(11-7-22)25-12-15-29-26(18-25)19-27(21-34-29)30(33)31-28-13-8-23(9-14-28)20-32(2)16-4-3-5-17-32;/h6-15,18-19H,3-5,16-17,20-21H2,1-2H3;1H