(4-ethoxycarbonylphenyl)-methyl-(2-phenylmethoxyethanoylamino)-prop-2-enyl-azanium

Systemtic Name: (4-ethoxycarbonylphenyl)-methyl-(2-phenylmethoxyethanoylamino)-prop-2-enyl-azanium Openeye Name: allyl-[(2-benzyloxyacetyl)amino]-(4-ethoxycarbonylphenyl)-methyl-ammonium CAS Name: (4-ethoxycarbonylphenyl)-methyl-[(1-oxo-2-phenylmethoxyethyl)amino]-prop-2-enylammonium IUPAC Name: (4-ethoxycarbonylphenyl)-methyl-[(2-phenylmethoxyacetyl)amino]-prop-2-enylazanium Traditional Name: allyl-[(2-benzoxyacetyl)amino]-(4-carbethoxyphenyl)-methyl-ammonium Formula: C22H27N2O4+ MolecularWeight: 383.46078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)[N+](C)(CC=C)NC(=O)COCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)[N+](C)(CC=C)NC(=O)COCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O4/c1-4-15-24(3,20-13-11-19(12-14-20)22(26)28-5-2)23-21(25)17-27-16-18-9-7-6-8-10-18/h4,6-14H,1,5,15-17H2,2-3H3/p+1