3-[(3S)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-morpholin-4-yl-propan-1-one

Systemtic Name: 3-[(3S)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-morpholin-4-yl-propan-1-one Openeye Name: 3-[(3S)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-morpholino-propan-1-one CAS Name: 3-[(3S)-1-[(9-ethyl-3-carbazolyl)methyl]-3-piperidin-1-iumyl]-1-(4-morpholinyl)-1-propanone IUPAC Name: 3-[(3S)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-morpholin-4-ylpropan-1-one Traditional Name: 3-[(3S)-1-[(9-ethylcarbazol-3-yl)methyl]piperidin-1-ium-3-yl]-1-morpholino-propan-1-one Formula: C27H36N3O2+ MolecularWeight: 434.59364

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C[NH+]3CCCC(C3)CCC(=O)N4CCOCC4)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C[NH+]3CCC[C@H](C3)CCC(=O)N4CCOCC4)C5=CC=CC=C51

InChI

InChI=1S/C27H35N3O2/c1-2-30-25-8-4-3-7-23(25)24-18-22(9-11-26(24)30)20-28-13-5-6-21(19-28)10-12-27(31)29-14-16-32-17-15-29/h3-4,7-9,11,18,21H,2,5-6,10,12-17,19-20H2,1H3/p+1/t21-/m0/s1