3-[(3-methoxy-4-prop-2-enoxy-phenyl)carbonylamino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[(3-methoxy-4-prop-2-enoxy-phenyl)carbonylamino]propyl-methyl-(phenylmethyl)azanium Openeye Name: 3-[(4-allyloxy-3-methoxy-benzoyl)amino]propyl-benzyl-methyl-ammonium CAS Name: 3-[[(3-methoxy-4-prop-2-enoxyphenyl)-oxomethyl]amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[(3-methoxy-4-prop-2-enoxybenzoyl)amino]propyl]-methylazanium Traditional Name: 3-[(4-allyloxy-3-methoxy-benzoyl)amino]propyl-benzyl-methyl-ammonium Formula: C22H29N2O3+ MolecularWeight: 369.47726

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1=CC(=C(C=C1)OCC=C)OC)CC2=CC=CC=C2

Isomeric SMILES

C[NH+](CCCNC(=O)C1=CC(=C(C=C1)OCC=C)OC)CC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O3/c1-4-15-27-20-12-11-19(16-21(20)26-3)22(25)23-13-8-14-24(2)17-18-9-6-5-7-10-18/h4-7,9-12,16H,1,8,13-15,17H2,2-3H3,(H,23,25)/p+1