[(3S)-3-(4-methoxy-3-methyl-phenyl)-3-pyrrolidin-1-ium-1-yl-propyl]azanium

Systemtic Name: [(3S)-3-(4-methoxy-3-methyl-phenyl)-3-pyrrolidin-1-ium-1-yl-propyl]azanium Openeye Name: [(3S)-3-(4-methoxy-3-methyl-phenyl)-3-pyrrolidin-1-ium-1-yl-propyl]ammonium CAS Name: [(3S)-3-(4-methoxy-3-methylphenyl)-3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(3S)-3-(4-methoxy-3-methylphenyl)-3-pyrrolidin-1-ium-1-ylpropyl]azanium Traditional Name: [(3S)-3-(4-methoxy-3-methyl-phenyl)-3-pyrrolidin-1-ium-1-yl-propyl]ammonium Formula: C15H26N2O+2 MolecularWeight: 250.37974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(CC[NH3+])[NH+]2CCCC2)OC

Isomeric SMILES

CC1=C(C=CC(=C1)[C@H](CC[NH3+])[NH+]2CCCC2)OC

InChI

InChI=1S/C15H24N2O/c1-12-11-13(5-6-15(12)18-2)14(7-8-16)17-9-3-4-10-17/h5-6,11,14H,3-4,7-10,16H2,1-2H3/p+2/t14-/m0/s1