(3S)-1-[(2,3-dimethoxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium

Systemtic Name: (3S)-1-[(2,3-dimethoxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium Openeye Name: (3S)-1-[(2,3-dimethoxyphenyl)methyl]-3-pyrrolidin-1-yl-piperidin-1-ium CAS Name: (3S)-1-[(2,3-dimethoxyphenyl)methyl]-3-(1-pyrrolidinyl)piperidin-1-ium IUPAC Name: (3S)-1-[(2,3-dimethoxyphenyl)methyl]-3-pyrrolidin-1-ylpiperidin-1-ium Traditional Name: (3S)-1-o-veratryl-3-pyrrolidino-piperidin-1-ium Formula: C18H29N2O2+ MolecularWeight: 305.43506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C[NH+]2CCCC(C2)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1OC)C[NH+]2CCC[C@@H](C2)N3CCCC3

InChI

InChI=1S/C18H28N2O2/c1-21-17-9-5-7-15(18(17)22-2)13-19-10-6-8-16(14-19)20-11-3-4-12-20/h5,7,9,16H,3-4,6,8,10-14H2,1-2H3/p+1/t16-/m0/s1