[3-[(2,5-dimethoxyphenyl)amino]-3-oxidanylidene-propyl]-ethyl-(phenylmethyl)azanium

Systemtic Name: [3-[(2,5-dimethoxyphenyl)amino]-3-oxidanylidene-propyl]-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-(2,5-dimethoxyanilino)-3-oxo-propyl]-ethyl-ammonium CAS Name: [3-(2,5-dimethoxyanilino)-3-oxopropyl]-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-(2,5-dimethoxyanilino)-3-oxopropyl]-ethylazanium Traditional Name: benzyl-[3-(2,5-dimethoxyanilino)-3-keto-propyl]-ethyl-ammonium Formula: C20H27N2O3+ MolecularWeight: 343.43998

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCC(=O)NC1=C(C=CC(=C1)OC)OC)CC2=CC=CC=C2

Isomeric SMILES

CC[NH+](CCC(=O)NC1=C(C=CC(=C1)OC)OC)CC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O3/c1-4-22(15-16-8-6-5-7-9-16)13-12-20(23)21-18-14-17(24-2)10-11-19(18)25-3/h5-11,14H,4,12-13,15H2,1-3H3,(H,21,23)/p+1