[3-[[methyl-[8-(9-oxidanylidenexanthen-3-yl)oxyoctyl]amino]methyl]phenyl] N-methylcarbamate

Systemtic Name: [3-[[methyl-[8-(9-oxidanylidenexanthen-3-yl)oxyoctyl]amino]methyl]phenyl] N-methylcarbamate Openeye Name: [3-[[methyl-[8-(9-oxoxanthen-3-yl)oxyoctyl]amino]methyl]phenyl] N-methylcarbamate CAS Name: N-methylcarbamic acid [3-[[methyl-[8-[(9-oxo-3-xanthenyl)oxy]octyl]amino]methyl]phenyl] ester IUPAC Name: [3-[[methyl-[8-(9-oxoxanthen-3-yl)oxyoctyl]amino]methyl]phenyl] N-methylcarbamate Traditional Name: N-methylcarbamic acid [3-[[8-(9-ketoxanthen-3-yl)oxyoctyl-methyl-amino]methyl]phenyl] ester Formula: C31H36N2O5 MolecularWeight: 516.62794

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OC1=CC=CC(=C1)CN(C)CCCCCCCCOC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4O3

Isomeric SMILES

CNC(=O)OC1=CC=CC(=C1)CN(C)CCCCCCCCOC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C31H36N2O5/c1-32-31(35)37-25-13-11-12-23(20-25)22-33(2)18-9-5-3-4-6-10-19-36-24-16-17-27-29(21-24)38-28-15-8-7-14-26(28)30(27)34/h7-8,11-17,20-21H,3-6,9-10,18-19,22H2,1-2H3,(H,32,35)