[(1S)-1-(4-tert-butylphenyl)-2-[(7-methyl-4-oxidanylidene-chromen-2-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(4-tert-butylphenyl)-2-[(7-methyl-4-oxidanylidene-chromen-2-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-tert-butylphenyl)-2-[(7-methyl-4-oxo-chromene-2-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-tert-butylphenyl)-2-[[(7-methyl-4-oxo-1-benzopyran-2-yl)-oxomethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-tert-butylphenyl)-2-[(7-methyl-4-oxochromene-2-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-tert-butylphenyl)-2-[(4-keto-7-methyl-chromene-2-carbonyl)amino]ethyl]-dimethyl-ammonium Formula: C25H31N2O3+ MolecularWeight: 407.52524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C=C(O2)C(=O)NCC(C3=CC=C(C=C3)C(C)(C)C)[NH+](C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C=C(O2)C(=O)NC[C@H](C3=CC=C(C=C3)C(C)(C)C)[NH+](C)C

InChI

InChI=1S/C25H30N2O3/c1-16-7-12-19-21(28)14-23(30-22(19)13-16)24(29)26-15-20(27(5)6)17-8-10-18(11-9-17)25(2,3)4/h7-14,20H,15H2,1-6H3,(H,26,29)/p+1/t20-/m1/s1