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

Systemtic Name: ethyl-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl]-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: ethyl-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl]-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: ethyl-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl]-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: ethyl-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl]-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: ethyl-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl]-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C23H29N2O3S+ MolecularWeight: 413.55296

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=O)OC2=CC(=C(C=C12)C(C)C)C)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CC[NH+](CC1=CC(=O)OC2=CC(=C(C=C12)C(C)C)C)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C23H28N2O3S/c1-5-25(14-22(26)24-12-18-7-6-8-29-18)13-17-10-23(27)28-21-9-16(4)19(15(2)3)11-20(17)21/h6-11,15H,5,12-14H2,1-4H3,(H,24,26)/p+1