[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]-[(2,3-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: (2,3-dimethoxyphenyl)methyl-[2-(indan-5-ylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-[(2,3-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-[(2,3-dimethoxyphenyl)methyl]-methylazanium Traditional Name: [2-(indan-5-ylamino)-2-keto-ethyl]-methyl-o-veratryl-ammonium Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC(=O)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

C[NH+](CC1=C(C(=CC=C1)OC)OC)CC(=O)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C21H26N2O3/c1-23(13-17-8-5-9-19(25-2)21(17)26-3)14-20(24)22-18-11-10-15-6-4-7-16(15)12-18/h5,8-12H,4,6-7,13-14H2,1-3H3,(H,22,24)/p+1