[(3S)-1-[5-[3-(4-methoxyphenyl)propylcarbamoyl]pyridin-1-ium-2-yl]pyrrolidin-3-yl]-dimethyl-azanium

Systemtic Name: [(3S)-1-[5-[3-(4-methoxyphenyl)propylcarbamoyl]pyridin-1-ium-2-yl]pyrrolidin-3-yl]-dimethyl-azanium Openeye Name: [(3S)-1-[5-[3-(4-methoxyphenyl)propylcarbamoyl]pyridin-1-ium-2-yl]pyrrolidin-3-yl]-dimethyl-ammonium CAS Name: [(3S)-1-[5-[[3-(4-methoxyphenyl)propylamino]-oxomethyl]-2-pyridin-1-iumyl]-3-pyrrolidinyl]-dimethylammonium IUPAC Name: [(3S)-1-[5-[3-(4-methoxyphenyl)propylcarbamoyl]pyridin-1-ium-2-yl]pyrrolidin-3-yl]-dimethylazanium Traditional Name: [(3S)-1-[5-[3-(4-methoxyphenyl)propylcarbamoyl]pyridin-1-ium-2-yl]pyrrolidin-3-yl]-dimethyl-ammonium Formula: C22H32N4O2+2 MolecularWeight: 384.51508

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1CCN(C1)C2=[NH+]C=C(C=C2)C(=O)NCCCC3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](C)[C@H]1CCN(C1)C2=[NH+]C=C(C=C2)C(=O)NCCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H30N4O2/c1-25(2)19-12-14-26(16-19)21-11-8-18(15-24-21)22(27)23-13-4-5-17-6-9-20(28-3)10-7-17/h6-11,15,19H,4-5,12-14,16H2,1-3H3,(H,23,27)/p+2/t19-/m0/s1