N-methylsulfonyl-N-[4-[(3-nitroacridin-9-yl)amino]phenyl]pentanamide hydrochloride

Systemtic Name: N-methylsulfonyl-N-[4-[(3-nitroacridin-9-yl)amino]phenyl]pentanamide hydrochloride Openeye Name: N-methylsulfonyl-N-[4-[(3-nitroacridin-9-yl)amino]phenyl]pentanamide hydrochloride CAS Name: N-methylsulfonyl-N-[4-[(3-nitro-9-acridinyl)amino]phenyl]pentanamide hydrochloride IUPAC Name: N-methylsulfonyl-N-[4-[(3-nitroacridin-9-yl)amino]phenyl]pentanamide hydrochloride Traditional Name: N-mesyl-N-[4-[(3-nitroacridin-9-yl)amino]phenyl]valeramide hydrochloride Formula: C25H25ClN4O5S MolecularWeight: 529.0078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(C1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)[N+](=O)[O-])S(=O)(=O)C.Cl

Isomeric SMILES

CCCCC(=O)N(C1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)[N+](=O)[O-])S(=O)(=O)C.Cl

InChI

InChI=1S/C25H24N4O5S.ClH/c1-3-4-9-24(30)28(35(2,33)34)18-12-10-17(11-13-18)26-25-20-7-5-6-8-22(20)27-23-16-19(29(31)32)14-15-21(23)25;/h5-8,10-16H,3-4,9H2,1-2H3,(H,26,27);1H