[1-methyl-1-(phenethylamino)indol-1-ium-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-methyl-1-(phenethylamino)indol-1-ium-2-yl]-piperidin-1-yl-methanone Openeye Name: [1-methyl-1-(phenethylamino)indol-1-ium-2-yl]-(1-piperidyl)methanone CAS Name: [1-methyl-1-(phenethylamino)-2-indol-1-iumyl]-(1-piperidinyl)methanone IUPAC Name: [1-methyl-1-(phenethylamino)indol-1-ium-2-yl]-piperidin-1-ylmethanone Traditional Name: [1-methyl-1-(phenethylamino)indol-1-ium-2-yl]-piperidino-methanone Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2=CC=CC=C2C=C1C(=O)N3CCCCC3)NCCC4=CC=CC=C4

Isomeric SMILES

C[N+]1(C2=CC=CC=C2C=C1C(=O)N3CCCCC3)NCCC4=CC=CC=C4

InChI

InChI=1S/C23H28N3O/c1-26(24-15-14-19-10-4-2-5-11-19)21-13-7-6-12-20(21)18-22(26)23(27)25-16-8-3-9-17-25/h2,4-7,10-13,18,24H,3,8-9,14-17H2,1H3/q+1