N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(3-chloro-4-pyrrolidin-1-yl-phenyl)-2-morpholino-5-nitro-benzamide CAS Name: N-[3-chloro-4-(1-pyrrolidinyl)phenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(3-chloro-4-pyrrolidin-1-ylphenyl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(3-chloro-4-pyrrolidino-phenyl)-2-morpholino-5-nitro-benzamide Formula: C21H23ClN4O4 MolecularWeight: 430.88472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4)Cl

InChI

InChI=1S/C21H23ClN4O4/c22-18-13-15(3-5-20(18)24-7-1-2-8-24)23-21(27)17-14-16(26(28)29)4-6-19(17)25-9-11-30-12-10-25/h3-6,13-14H,1-2,7-12H2,(H,23,27)