[4-[2-[8-(2-methoxycarbonyl-5-phenylmethoxy-indol-1-yl)octylamino]-2-oxidanylidene-ethyl]phenyl]-trimethyl-azanium

Systemtic Name: [4-[2-[8-(2-methoxycarbonyl-5-phenylmethoxy-indol-1-yl)octylamino]-2-oxidanylidene-ethyl]phenyl]-trimethyl-azanium Openeye Name: [4-[2-[8-(5-benzyloxy-2-methoxycarbonyl-indol-1-yl)octylamino]-2-oxo-ethyl]phenyl]-trimethyl-ammonium CAS Name: [4-[2-[8-(2-methoxycarbonyl-5-phenylmethoxy-1-indolyl)octylamino]-2-oxoethyl]phenyl]-trimethylammonium IUPAC Name: [4-[2-[8-(2-methoxycarbonyl-5-phenylmethoxyindol-1-yl)octylamino]-2-oxoethyl]phenyl]-trimethylazanium Traditional Name: [4-[2-[8-(5-benzoxy-2-carbomethoxy-indol-1-yl)octylamino]-2-keto-ethyl]phenyl]-trimethyl-ammonium Formula: C36H46N3O4+ MolecularWeight: 584.76814

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)CC(=O)NCCCCCCCCN2C3=C(C=C(C=C3)OCC4=CC=CC=C4)C=C2C(=O)OC

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)CC(=O)NCCCCCCCCN2C3=C(C=C(C=C3)OCC4=CC=CC=C4)C=C2C(=O)OC

InChI

InChI=1S/C36H45N3O4/c1-39(2,3)31-18-16-28(17-19-31)24-35(40)37-22-12-7-5-6-8-13-23-38-33-21-20-32(43-27-29-14-10-9-11-15-29)25-30(33)26-34(38)36(41)42-4/h9-11,14-21,25-26H,5-8,12-13,22-24,27H2,1-4H3/p+1