[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-(diphenylmethyl)azanium

Systemtic Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-(diphenylmethyl)azanium Openeye Name: benzhydryl-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]ammonium CAS Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]-(diphenylmethyl)ammonium IUPAC Name: benzhydryl-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]azanium Traditional Name: benzhydryl-[2-(homoveratrylamino)-2-keto-ethyl]ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C[NH2+]C(C2=CC=CC=C2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C[NH2+]C(C2=CC=CC=C2)C3=CC=CC=C3)OC

InChI

InChI=1S/C25H28N2O3/c1-29-22-14-13-19(17-23(22)30-2)15-16-26-24(28)18-27-25(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,17,25,27H,15-16,18H2,1-2H3,(H,26,28)/p+1