(4-methoxy-3-phenylmethoxy-phenyl)methyl-pentan-3-yl-azanium

Systemtic Name: (4-methoxy-3-phenylmethoxy-phenyl)methyl-pentan-3-yl-azanium Openeye Name: (3-benzyloxy-4-methoxy-phenyl)methyl-(1-ethylpropyl)ammonium CAS Name: (4-methoxy-3-phenylmethoxyphenyl)methyl-pentan-3-ylammonium IUPAC Name: (4-methoxy-3-phenylmethoxyphenyl)methyl-pentan-3-ylazanium Traditional Name: (3-benzoxy-4-methoxy-benzyl)-(1-ethylpropyl)ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC1=CC(=C(C=C1)OC)OCC2=CC=CC=C2

Isomeric SMILES

CCC(CC)[NH2+]CC1=CC(=C(C=C1)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C20H27NO2/c1-4-18(5-2)21-14-17-11-12-19(22-3)20(13-17)23-15-16-9-7-6-8-10-16/h6-13,18,21H,4-5,14-15H2,1-3H3/p+1