ethyl N-[3-[(3,6-dinitroacridin-9-yl)amino]-5-(hydroxymethyl)phenyl]carbamate

Systemtic Name: ethyl N-[3-[(3,6-dinitroacridin-9-yl)amino]-5-(hydroxymethyl)phenyl]carbamate Openeye Name: ethyl N-[3-[(3,6-dinitroacridin-9-yl)amino]-5-(hydroxymethyl)phenyl]carbamate CAS Name: N-[3-[(3,6-dinitro-9-acridinyl)amino]-5-(hydroxymethyl)phenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-[(3,6-dinitroacridin-9-yl)amino]-5-(hydroxymethyl)phenyl]carbamate Traditional Name: N-[3-[(3,6-dinitroacridin-9-yl)amino]-5-methylol-phenyl]carbamic acid ethyl ester Formula: C23H19N5O7 MolecularWeight: 477.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC(=CC3=NC4=C2C=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])CO

Isomeric SMILES

CCOC(=O)NC1=CC(=CC(=C1)NC2=C3C=CC(=CC3=NC4=C2C=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])CO

InChI

InChI=1S/C23H19N5O7/c1-2-35-23(30)25-15-8-13(12-29)7-14(9-15)24-22-18-5-3-16(27(31)32)10-20(18)26-21-11-17(28(33)34)4-6-19(21)22/h3-11,29H,2,12H2,1H3,(H,24,26)(H,25,30)