tert-butyl N-[3-(hydroxymethyl)-5-[(4-nitroacridin-9-yl)amino]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-(hydroxymethyl)-5-[(4-nitroacridin-9-yl)amino]phenyl]carbamate Openeye Name: tert-butyl N-[3-(hydroxymethyl)-5-[(4-nitroacridin-9-yl)amino]phenyl]carbamate CAS Name: N-[3-(hydroxymethyl)-5-[(4-nitro-9-acridinyl)amino]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(hydroxymethyl)-5-[(4-nitroacridin-9-yl)amino]phenyl]carbamate Traditional Name: N-[3-methylol-5-[(4-nitroacridin-9-yl)amino]phenyl]carbamic acid tert-butyl ester Formula: C25H24N4O5 MolecularWeight: 460.48186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)[N+](=O)[O-])CO

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)[N+](=O)[O-])CO

InChI

InChI=1S/C25H24N4O5/c1-25(2,3)34-24(31)27-17-12-15(14-30)11-16(13-17)26-22-18-7-4-5-9-20(18)28-23-19(22)8-6-10-21(23)29(32)33/h4-13,30H,14H2,1-3H3,(H,26,28)(H,27,31)