4-[(S)-(4-ethylphenyl)-pyrrolidin-1-ium-1-yl-methyl]piperidin-1-ium

Systemtic Name: 4-[(S)-(4-ethylphenyl)-pyrrolidin-1-ium-1-yl-methyl]piperidin-1-ium Openeye Name: 4-[(S)-(4-ethylphenyl)-pyrrolidin-1-ium-1-yl-methyl]piperidin-1-ium CAS Name: 4-[(S)-(4-ethylphenyl)-(1-pyrrolidin-1-iumyl)methyl]piperidin-1-ium IUPAC Name: 4-[(S)-(4-ethylphenyl)-pyrrolidin-1-ium-1-ylmethyl]piperidin-1-ium Traditional Name: 4-[(S)-(4-ethylphenyl)-pyrrolidin-1-ium-1-yl-methyl]piperidin-1-ium Formula: C18H30N2+2 MolecularWeight: 274.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2CC[NH2+]CC2)[NH+]3CCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2CC[NH2+]CC2)[NH+]3CCCC3

InChI

InChI=1S/C18H28N2/c1-2-15-5-7-16(8-6-15)18(20-13-3-4-14-20)17-9-11-19-12-10-17/h5-8,17-19H,2-4,9-14H2,1H3/p+2/t18-/m1/s1