(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]azanium

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]azanium Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]ammonium CAS Name: (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl-[(2R)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]ammonium IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]azanium Traditional Name: (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]ammonium Formula: C24H32N2O3S+2 MolecularWeight: 428.58748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]CC(C3=CC=CS3)[NH+]4CCOCC4)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]C[C@H](C3=CC=CS3)[NH+]4CCOCC4)C(C)C

InChI

InChI=1S/C24H30N2O3S/c1-16(2)19-13-20-18(12-24(27)29-22(20)11-17(19)3)14-25-15-21(23-5-4-10-30-23)26-6-8-28-9-7-26/h4-5,10-13,16,21,25H,6-9,14-15H2,1-3H3/p+2/t21-/m1/s1