(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl-prop-2-enyl-azanium

Systemtic Name: (3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl-prop-2-enyl-azanium Openeye Name: allyl-[(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methyl]ammonium CAS Name: (3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methyl-prop-2-enylammonium IUPAC Name: (3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methyl-prop-2-enylazanium Traditional Name: allyl-(4-benzoxy-3-bromo-5-ethoxy-benzyl)ammonium Formula: C19H23BrNO2+ MolecularWeight: 377.29542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CC=C)Br)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CC=C)Br)OCC2=CC=CC=C2

InChI

InChI=1S/C19H22BrNO2/c1-3-10-21-13-16-11-17(20)19(18(12-16)22-4-2)23-14-15-8-6-5-7-9-15/h3,5-9,11-12,21H,1,4,10,13-14H2,2H3/p+1