(E)-3-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]indol-3-yl]-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]indol-3-yl]-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]indol-3-yl]-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[1-[(4-methyl-1-piperazin-4-iumyl)methyl]-3-indolyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]indol-3-yl]-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[1-[(4-methylpiperazin-4-ium-1-yl)methyl]indol-3-yl]-1-phenyl-prop-2-en-1-one Formula: C23H26N3O+ MolecularWeight: 360.47204

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CN2C=C(C3=CC=CC=C32)C=CC(=O)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)CN2C=C(C3=CC=CC=C32)/C=C/C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O/c1-24-13-15-25(16-14-24)18-26-17-20(21-9-5-6-10-22(21)26)11-12-23(27)19-7-3-2-4-8-19/h2-12,17H,13-16,18H2,1H3/p+1/b12-11+