N'-(1-nitroacridin-9-yl)-N-(phenylmethyl)propane-1,3-diamine

Systemtic Name: N'-(1-nitroacridin-9-yl)-N-(phenylmethyl)propane-1,3-diamine Openeye Name: N-benzyl-N'-(1-nitroacridin-9-yl)propane-1,3-diamine CAS Name: N'-(1-nitro-9-acridinyl)-N-(phenylmethyl)propane-1,3-diamine IUPAC Name: N-benzyl-N'-(1-nitroacridin-9-yl)propane-1,3-diamine Traditional Name: benzyl-[3-[(1-nitroacridin-9-yl)amino]propyl]amine Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCCNC2=C3C(=NC4=CC=CC=C42)C=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNCCCNC2=C3C(=NC4=CC=CC=C42)C=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O2/c28-27(29)21-13-6-12-20-22(21)23(18-10-4-5-11-19(18)26-20)25-15-7-14-24-16-17-8-2-1-3-9-17/h1-6,8-13,24H,7,14-16H2,(H,25,26)