6-(1-methyl-1,4-diazepan-1-ium-1-yl)-1-propan-2-yl-indole

Systemtic Name: 6-(1-methyl-1,4-diazepan-1-ium-1-yl)-1-propan-2-yl-indole Openeye Name: 1-isopropyl-6-(1-methyl-1,4-diazepan-1-ium-1-yl)indole CAS Name: 6-(1-methyl-1,4-diazepan-1-ium-1-yl)-1-propan-2-ylindole IUPAC Name: 6-(1-methyl-1,4-diazepan-1-ium-1-yl)-1-propan-2-ylindole Traditional Name: 1-isopropyl-6-(1-methyl-1,4-diazepan-1-ium-1-yl)indole Formula: C17H26N3+ MolecularWeight: 272.40844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=CC2=C1C=C(C=C2)[N+]3(CCCNCC3)C

Isomeric SMILES

CC(C)N1C=CC2=C1C=C(C=C2)[N+]3(CCCNCC3)C

InChI

InChI=1S/C17H26N3/c1-14(2)19-10-7-15-5-6-16(13-17(15)19)20(3)11-4-8-18-9-12-20/h5-7,10,13-14,18H,4,8-9,11-12H2,1-3H3/q+1