N-(4-chloranyl-3-nitro-phenyl)-4-(3-morpholin-4-ylpropylamino)-3-nitro-benzamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-4-(3-morpholin-4-ylpropylamino)-3-nitro-benzamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-4-(3-morpholinopropylamino)-3-nitro-benzamide CAS Name: N-(4-chloro-3-nitrophenyl)-4-[3-(4-morpholinyl)propylamino]-3-nitrobenzamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-4-(3-morpholin-4-ylpropylamino)-3-nitrobenzamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-4-(3-morpholinopropylamino)-3-nitro-benzamide Formula: C20H22ClN5O6 MolecularWeight: 463.87158

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCCNC2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H22ClN5O6/c21-16-4-3-15(13-18(16)25(28)29)23-20(27)14-2-5-17(19(12-14)26(30)31)22-6-1-7-24-8-10-32-11-9-24/h2-5,12-13,22H,1,6-11H2,(H,23,27)