[(2R,3R)-3-cyclopropylcarbonyloxy-2-methyl-3,4-diphenyl-butyl]-methyl-phenethyl-azanium

Systemtic Name: [(2R,3R)-3-cyclopropylcarbonyloxy-2-methyl-3,4-diphenyl-butyl]-methyl-phenethyl-azanium Openeye Name: [(2R,3R)-3-(cyclopropanecarbonyloxy)-2-methyl-3,4-diphenyl-butyl]-methyl-phenethyl-ammonium CAS Name: [(2R,3R)-3-[cyclopropyl(oxo)methoxy]-2-methyl-3,4-diphenylbutyl]-methyl-phenethylammonium IUPAC Name: [(2R,3R)-3-(cyclopropanecarbonyloxy)-2-methyl-3,4-diphenylbutyl]-methyl-phenethylazanium Traditional Name: [(2R,3R)-3-(cyclopropanecarbonyloxy)-2-methyl-3,4-diphenyl-butyl]-methyl-phenethyl-ammonium Formula: C30H36NO2+ MolecularWeight: 442.61234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+](C)CCC1=CC=CC=C1)C(CC2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)C4CC4

Isomeric SMILES

C[C@H](C[NH+](C)CCC1=CC=CC=C1)[C@](CC2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)C4CC4

InChI

InChI=1S/C30H35NO2/c1-24(23-31(2)21-20-25-12-6-3-7-13-25)30(28-16-10-5-11-17-28,33-29(32)27-18-19-27)22-26-14-8-4-9-15-26/h3-17,24,27H,18-23H2,1-2H3/p+1/t24-,30-/m1/s1