methyl N-[3-(hydroxymethyl)-5-[(3-nitroacridin-9-yl)amino]phenyl]carbamate

Systemtic Name: methyl N-[3-(hydroxymethyl)-5-[(3-nitroacridin-9-yl)amino]phenyl]carbamate Openeye Name: methyl N-[3-(hydroxymethyl)-5-[(3-nitroacridin-9-yl)amino]phenyl]carbamate CAS Name: N-[3-(hydroxymethyl)-5-[(3-nitro-9-acridinyl)amino]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[3-(hydroxymethyl)-5-[(3-nitroacridin-9-yl)amino]phenyl]carbamate Traditional Name: N-[3-methylol-5-[(3-nitroacridin-9-yl)amino]phenyl]carbamic acid methyl ester Formula: C22H18N4O5 MolecularWeight: 418.40212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)[N+](=O)[O-])CO

Isomeric SMILES

COC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)[N+](=O)[O-])CO

InChI

InChI=1S/C22H18N4O5/c1-31-22(28)24-15-9-13(12-27)8-14(10-15)23-21-17-4-2-3-5-19(17)25-20-11-16(26(29)30)6-7-18(20)21/h2-11,27H,12H2,1H3,(H,23,25)(H,24,28)