3-[(3R)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[(3R)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[(3R)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[(3R)-1-[(9-ethyl-3-carbazolyl)methyl]-3-piperidin-1-iumyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[(3R)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[(3R)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-pyrrolidino-propan-1-one Formula: C27H36N3O+ MolecularWeight: 418.59424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CCCC(C3)CCC(=O)N4CCCC4)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CCC[C@@H](C3)CCC(=O)N4CCCC4)C5=CC=CC=C51

InChI

InChI=1S/C27H35N3O/c1-2-30-25-10-4-3-9-23(25)24-18-22(11-13-26(24)30)20-28-15-7-8-21(19-28)12-14-27(31)29-16-5-6-17-29/h3-4,9-11,13,18,21H,2,5-8,12,14-17,19-20H2,1H3/p+1/t21-/m1/s1