[3-[[methyl-[10-(9-oxidanylidenexanthen-3-yl)oxydecyl]amino]methyl]phenyl] N-methylcarbamate chloride

Systemtic Name: [3-[[methyl-[10-(9-oxidanylidenexanthen-3-yl)oxydecyl]amino]methyl]phenyl] N-methylcarbamate chloride Openeye Name: [3-[[methyl-[10-(9-oxoxanthen-3-yl)oxydecyl]amino]methyl]phenyl] N-methylcarbamate chloride CAS Name: N-methylcarbamic acid [3-[[methyl-[10-[(9-oxo-3-xanthenyl)oxy]decyl]amino]methyl]phenyl] ester chloride IUPAC Name: [3-[[methyl-[10-(9-oxoxanthen-3-yl)oxydecyl]amino]methyl]phenyl] N-methylcarbamate chloride Traditional Name: N-methylcarbamic acid [3-[[10-(9-ketoxanthen-3-yl)oxydecyl-methyl-amino]methyl]phenyl] ester chloride Formula: C33H40ClN2O5- MolecularWeight: 580.1341

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OC1=CC=CC(=C1)CN(C)CCCCCCCCCCOC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4O3.[Cl-]

Isomeric SMILES

CNC(=O)OC1=CC=CC(=C1)CN(C)CCCCCCCCCCOC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4O3.[Cl-]

InChI

InChI=1S/C33H40N2O5.ClH/c1-34-33(37)39-27-15-13-14-25(22-27)24-35(2)20-11-7-5-3-4-6-8-12-21-38-26-18-19-29-31(23-26)40-30-17-10-9-16-28(30)32(29)36;/h9-10,13-19,22-23H,3-8,11-12,20-21,24H2,1-2H3,(H,34,37);1H/p-1