2-[5-[6-(phenylmethoxycarbonylamino)hexanoyloxy]-1H-indol-3-yl]ethyl-(triphenylmethyl)azanium

Systemtic Name: 2-[5-[6-(phenylmethoxycarbonylamino)hexanoyloxy]-1H-indol-3-yl]ethyl-(triphenylmethyl)azanium Openeye Name: 2-[5-[6-(benzyloxycarbonylamino)hexanoyloxy]-1H-indol-3-yl]ethyl-trityl-ammonium CAS Name: 2-[5-[1-oxo-6-(phenylmethoxycarbonylamino)hexoxy]-1H-indol-3-yl]ethyl-(triphenylmethyl)ammonium IUPAC Name: 2-[5-[6-(phenylmethoxycarbonylamino)hexanoyloxy]-1H-indol-3-yl]ethyl-tritylazanium Traditional Name: 2-[5-[6-(benzyloxycarbonylamino)hexanoyloxy]-1H-indol-3-yl]ethyl-trityl-ammonium Formula: C43H44N3O4+ MolecularWeight: 666.82716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCCC(=O)OC2=CC3=C(C=C2)NC=C3CC[NH2+]C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCCC(=O)OC2=CC3=C(C=C2)NC=C3CC[NH2+]C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C43H43N3O4/c47-41(24-14-5-15-28-44-42(48)49-32-33-16-6-1-7-17-33)50-38-25-26-40-39(30-38)34(31-45-40)27-29-46-43(35-18-8-2-9-19-35,36-20-10-3-11-21-36)37-22-12-4-13-23-37/h1-4,6-13,16-23,25-26,30-31,45-46H,5,14-15,24,27-29,32H2,(H,44,48)/p+1