[(1S)-2-cyclohexyl-3-oxidanylidene-1H-isoindol-1-yl]-[2-(3,4-dimethoxyphenyl)ethyl]azanium

Systemtic Name: [(1S)-2-cyclohexyl-3-oxidanylidene-1H-isoindol-1-yl]-[2-(3,4-dimethoxyphenyl)ethyl]azanium Openeye Name: [(1S)-2-cyclohexyl-3-oxo-isoindolin-1-yl]-[2-(3,4-dimethoxyphenyl)ethyl]ammonium CAS Name: [(1S)-2-cyclohexyl-3-oxo-1H-isoindol-1-yl]-[2-(3,4-dimethoxyphenyl)ethyl]ammonium IUPAC Name: [(1S)-2-cyclohexyl-3-oxo-1H-isoindol-1-yl]-[2-(3,4-dimethoxyphenyl)ethyl]azanium Traditional Name: [(1S)-2-cyclohexyl-3-keto-isoindolin-1-yl]-homoveratryl-ammonium Formula: C24H31N2O3+ MolecularWeight: 395.51454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]C2C3=CC=CC=C3C(=O)N2C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+][C@@H]2C3=CC=CC=C3C(=O)N2C4CCCCC4)OC

InChI

InChI=1S/C24H30N2O3/c1-28-21-13-12-17(16-22(21)29-2)14-15-25-23-19-10-6-7-11-20(19)24(27)26(23)18-8-4-3-5-9-18/h6-7,10-13,16,18,23,25H,3-5,8-9,14-15H2,1-2H3/p+1/t23-/m0/s1