(2-methoxy-2-oxidanylidene-ethyl)-[3-(5-methyl-2-oxidanyl-phenyl)-3-phenyl-propyl]-di(propan-2-yl)azanium

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl)-[3-(5-methyl-2-oxidanyl-phenyl)-3-phenyl-propyl]-di(propan-2-yl)azanium Openeye Name: [3-(2-hydroxy-5-methyl-phenyl)-3-phenyl-propyl]-diisopropyl-(2-methoxy-2-oxo-ethyl)ammonium CAS Name: [3-(2-hydroxy-5-methylphenyl)-3-phenylpropyl]-(2-methoxy-2-oxoethyl)-di(propan-2-yl)ammonium IUPAC Name: [3-(2-hydroxy-5-methylphenyl)-3-phenylpropyl]-(2-methoxy-2-oxoethyl)-di(propan-2-yl)azanium Traditional Name: [3-(2-hydroxy-5-methyl-phenyl)-3-phenyl-propyl]-diisopropyl-(2-keto-2-methoxy-ethyl)ammonium Formula: C25H36NO3+ MolecularWeight: 398.55824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(CC[N+](CC(=O)OC)(C(C)C)C(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(CC[N+](CC(=O)OC)(C(C)C)C(C)C)C2=CC=CC=C2

InChI

InChI=1S/C25H35NO3/c1-18(2)26(19(3)4,17-25(28)29-6)15-14-22(21-10-8-7-9-11-21)23-16-20(5)12-13-24(23)27/h7-13,16,18-19,22H,14-15,17H2,1-6H3/p+1