1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanone Openeye Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanone CAS Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]ethanone IUPAC Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanone Traditional Name: 1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanone Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C(=O)C[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(N1)C)C(=O)C[NH+]2CCC(CC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H25N3O/c1-14-11-18(15(2)23-14)21(25)13-24-9-7-16(8-10-24)19-12-22-20-6-4-3-5-17(19)20/h3-6,11-12,16,22-23H,7-10,13H2,1-2H3/p+1