6-methyl-2-[4-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]carbonyl-chromen-4-one

Systemtic Name: 6-methyl-2-[4-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]carbonyl-chromen-4-one Openeye Name: 6-methyl-2-[4-(2-piperidin-1-ium-1-ylethyl)piperidine-1-carbonyl]chromen-4-one CAS Name: 6-methyl-2-[oxo-[4-[2-(1-piperidin-1-iumyl)ethyl]-1-piperidinyl]methyl]-1-benzopyran-4-one IUPAC Name: 6-methyl-2-[4-(2-piperidin-1-ium-1-ylethyl)piperidine-1-carbonyl]chromen-4-one Traditional Name: 6-methyl-2-[4-(2-piperidin-1-ium-1-ylethyl)piperidine-1-carbonyl]chromone Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)N3CCC(CC3)CC[NH+]4CCCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)N3CCC(CC3)CC[NH+]4CCCCC4

InChI

InChI=1S/C23H30N2O3/c1-17-5-6-21-19(15-17)20(26)16-22(28-21)23(27)25-13-8-18(9-14-25)7-12-24-10-3-2-4-11-24/h5-6,15-16,18H,2-4,7-14H2,1H3/p+1