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

Systemtic Name: tert-butyl N-[3-(hydroxymethyl)-5-[(4-methoxyacridin-9-yl)amino]phenyl]carbamate Openeye Name: tert-butyl N-[3-(hydroxymethyl)-5-[(4-methoxyacridin-9-yl)amino]phenyl]carbamate CAS Name: N-[3-(hydroxymethyl)-5-[(4-methoxy-9-acridinyl)amino]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(hydroxymethyl)-5-[(4-methoxyacridin-9-yl)amino]phenyl]carbamate Traditional Name: N-[3-[(4-methoxyacridin-9-yl)amino]-5-methylol-phenyl]carbamic acid tert-butyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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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)OC)CO

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC=C(C3=NC4=CC=CC=C42)OC)CO

InChI

InChI=1S/C26H27N3O4/c1-26(2,3)33-25(31)28-18-13-16(15-30)12-17(14-18)27-23-19-8-5-6-10-21(19)29-24-20(23)9-7-11-22(24)32-4/h5-14,30H,15H2,1-4H3,(H,27,29)(H,28,31)