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trimethyl-[3-[8-(5-nitroindol-1-yl)octoxycarbonyl]phenyl]azanium

trimethyl-[3-[8-(5-nitroindol-1-yl)octoxycarbonyl]phenyl]azanium

Systemtic Name:trimethyl-[3-[8-(5-nitroindol-1-yl)octoxycarbonyl]phenyl]azanium
Openeye Name:trimethyl-[3-[8-(5-nitroindol-1-yl)octoxycarbonyl]phenyl]ammonium
CAS Name:trimethyl-[3-[8-(5-nitro-1-indolyl)octoxy-oxomethyl]phenyl]ammonium
IUPAC Name:trimethyl-[3-[8-(5-nitroindol-1-yl)octoxycarbonyl]phenyl]azanium
Traditional Name:trimethyl-[3-[8-(5-nitroindol-1-yl)octoxycarbonyl]phenyl]ammonium
Formula: C26H34N3O4+
MolecularWeight: 452.56586
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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=CC(=C1)C(=O)OCCCCCCCCN2C=CC3=C2C=CC(=C3)[N+](=O)[O-]


Isomeric SMILES

C[N+](C)(C)C1=CC=CC(=C1)C(=O)OCCCCCCCCN2C=CC3=C2C=CC(=C3)[N+](=O)[O-]


InChI

InChI=1S/C26H34N3O4/c1-29(2,3)24-12-10-11-22(20-24)26(30)33-18-9-7-5-4-6-8-16-27-17-15-21-19-23(28(31)32)13-14-25(21)27/h10-15,17,19-20H,4-9,16,18H2,1-3H3/q+1


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