9-azanyl-N-[2-[3-(2-azanylpropan-2-yl)-2-nitro-phenyl]ethyl]-5-methyl-acridine-4-carboxamide

Systemtic Name: 9-azanyl-N-[2-[3-(2-azanylpropan-2-yl)-2-nitro-phenyl]ethyl]-5-methyl-acridine-4-carboxamide Openeye Name: 9-amino-N-[2-[3-(1-amino-1-methyl-ethyl)-2-nitro-phenyl]ethyl]-5-methyl-acridine-4-carboxamide CAS Name: 9-amino-N-[2-[3-(2-aminopropan-2-yl)-2-nitrophenyl]ethyl]-5-methyl-4-acridinecarboxamide IUPAC Name: 9-amino-N-[2-[3-(2-aminopropan-2-yl)-2-nitrophenyl]ethyl]-5-methylacridine-4-carboxamide Traditional Name: 9-amino-N-[2-[3-(1-amino-1-methyl-ethyl)-2-nitro-phenyl]ethyl]-5-methyl-acridine-4-carboxamide Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)NCCC4=C(C(=CC=C4)C(C)(C)N)[N+](=O)[O-])N=C12)N

Isomeric SMILES

CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)NCCC4=C(C(=CC=C4)C(C)(C)N)[N+](=O)[O-])N=C12)N

InChI

InChI=1S/C26H27N5O3/c1-15-7-4-9-17-21(27)18-10-6-11-19(23(18)30-22(15)17)25(32)29-14-13-16-8-5-12-20(26(2,3)28)24(16)31(33)34/h4-12H,13-14,28H2,1-3H3,(H2,27,30)(H,29,32)