N-[2-(2-azanylpropylamino)propyl]-4-nitro-N-(4-nitrophenyl)carbonyl-benzamide hydrochloride

Systemtic Name: N-[2-(2-azanylpropylamino)propyl]-4-nitro-N-(4-nitrophenyl)carbonyl-benzamide hydrochloride Openeye Name: N-[2-(2-aminopropylamino)propyl]-4-nitro-N-(4-nitrobenzoyl)benzamide hydrochloride CAS Name: N-[2-(2-aminopropylamino)propyl]-4-nitro-N-[(4-nitrophenyl)-oxomethyl]benzamide hydrochloride IUPAC Name: N-[2-(2-aminopropylamino)propyl]-4-nitro-N-(4-nitrobenzoyl)benzamide hydrochloride Traditional Name: N-[2-(2-aminopropylamino)propyl]-4-nitro-N-(4-nitrobenzoyl)benzamide hydrochloride Formula: C20H24ClN5O6 MolecularWeight: 465.88746

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(C)CN(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=C(C=C2)[N+](=O)[O-])N.Cl

Isomeric SMILES

CC(CNC(C)CN(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=C(C=C2)[N+](=O)[O-])N.Cl

InChI

InChI=1S/C20H23N5O6.ClH/c1-13(21)11-22-14(2)12-23(19(26)15-3-7-17(8-4-15)24(28)29)20(27)16-5-9-18(10-6-16)25(30)31;/h3-10,13-14,22H,11-12,21H2,1-2H3;1H