(E)-3-[1-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propyl]indol-3-yl]-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-[1-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propyl]indol-3-yl]-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-[1-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propyl]indol-3-yl]-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[1-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propyl]-3-indolyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-[1-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropyl]indol-3-yl]-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[1-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propyl]indol-3-yl]-1-phenyl-prop-2-en-1-one Formula: C25H29N2O2+ MolecularWeight: 389.50996

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(CN2C=C(C3=CC=CC=C32)C=CC(=O)C4=CC=CC=C4)O

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](CN2C=C(C3=CC=CC=C32)/C=C/C(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C25H28N2O2/c28-22(18-26-15-7-2-8-16-26)19-27-17-21(23-11-5-6-12-24(23)27)13-14-25(29)20-9-3-1-4-10-20/h1,3-6,9-14,17,22,28H,2,7-8,15-16,18-19H2/p+1/b14-13+/t22-/m0/s1