[4-methyl-7-oxidanyl-2-oxidanylidene-3-(phenylmethyl)chromen-8-yl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: [4-methyl-7-oxidanyl-2-oxidanylidene-3-(phenylmethyl)chromen-8-yl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: (3-benzyl-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: [7-hydroxy-4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-8-yl]methyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: (3-benzyl-7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: (3-benzyl-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C24H30N2O4+2 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH2+]CC[NH+]3CCOCC3)O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH2+]CC[NH+]3CCOCC3)O)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N2O4/c1-17-19-7-8-22(27)21(16-25-9-10-26-11-13-29-14-12-26)23(19)30-24(28)20(17)15-18-5-3-2-4-6-18/h2-8,25,27H,9-16H2,1H3/p+2