1-[4-(aminomethyl)phenyl]-3-[4-[(3-nitroacridin-9-yl)amino]phenyl]urea

Systemtic Name: 1-[4-(aminomethyl)phenyl]-3-[4-[(3-nitroacridin-9-yl)amino]phenyl]urea Openeye Name: 1-[4-(aminomethyl)phenyl]-3-[4-[(3-nitroacridin-9-yl)amino]phenyl]urea CAS Name: 1-[4-(aminomethyl)phenyl]-3-[4-[(3-nitro-9-acridinyl)amino]phenyl]urea IUPAC Name: 1-[4-(aminomethyl)phenyl]-3-[4-[(3-nitroacridin-9-yl)amino]phenyl]urea Traditional Name: 1-[4-(aminomethyl)phenyl]-3-[4-[(3-nitroacridin-9-yl)amino]phenyl]urea Formula: C27H22N6O3 MolecularWeight: 478.50198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC(=CC3=N2)[N+](=O)[O-])NC4=CC=C(C=C4)NC(=O)NC5=CC=C(C=C5)CN

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC(=CC3=N2)[N+](=O)[O-])NC4=CC=C(C=C4)NC(=O)NC5=CC=C(C=C5)CN

InChI

InChI=1S/C27H22N6O3/c28-16-17-5-7-19(8-6-17)30-27(34)31-20-11-9-18(10-12-20)29-26-22-3-1-2-4-24(22)32-25-15-21(33(35)36)13-14-23(25)26/h1-15H,16,28H2,(H,29,32)(H2,30,31,34)