trimethyl-[4-[2-[9-(2-methyl-5-phenylmethoxy-indol-1-yl)nonoxy]-2-oxidanylidene-ethyl]phenyl]azanium

Systemtic Name: trimethyl-[4-[2-[9-(2-methyl-5-phenylmethoxy-indol-1-yl)nonoxy]-2-oxidanylidene-ethyl]phenyl]azanium Openeye Name: [4-[2-[9-(5-benzyloxy-2-methyl-indol-1-yl)nonoxy]-2-oxo-ethyl]phenyl]-trimethyl-ammonium CAS Name: trimethyl-[4-[2-[9-(2-methyl-5-phenylmethoxy-1-indolyl)nonoxy]-2-oxoethyl]phenyl]ammonium IUPAC Name: trimethyl-[4-[2-[9-(2-methyl-5-phenylmethoxyindol-1-yl)nonoxy]-2-oxoethyl]phenyl]azanium Traditional Name: [4-[2-[9-(5-benzoxy-2-methyl-indol-1-yl)nonoxy]-2-keto-ethyl]phenyl]-trimethyl-ammonium Formula: C36H47N2O3+ MolecularWeight: 555.76998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1CCCCCCCCCOC(=O)CC3=CC=C(C=C3)[N+](C)(C)C)C=CC(=C2)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(N1CCCCCCCCCOC(=O)CC3=CC=C(C=C3)[N+](C)(C)C)C=CC(=C2)OCC4=CC=CC=C4

InChI

InChI=1S/C36H47N2O3/c1-29-25-32-27-34(41-28-31-15-11-10-12-16-31)21-22-35(32)37(29)23-13-8-6-5-7-9-14-24-40-36(39)26-30-17-19-33(20-18-30)38(2,3)4/h10-12,15-22,25,27H,5-9,13-14,23-24,26,28H2,1-4H3/q+1