3-(diethylamino)-N-[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]propanamide

Systemtic Name: 3-(diethylamino)-N-[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]propanamide Openeye Name: 3-(diethylamino)-N-[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]propanamide CAS Name: 3-(diethylamino)-N-[4-(1-hydroxy-6-nitro-2-benzimidazolyl)phenyl]propanamide IUPAC Name: 3-(diethylamino)-N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]propanamide Traditional Name: 3-(diethylamino)-N-[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]propionamide Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(=O)NC1=CC=C(C=C1)C2=NC3=C(N2O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCC(=O)NC1=CC=C(C=C1)C2=NC3=C(N2O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O4/c1-3-23(4-2)12-11-19(26)21-15-7-5-14(6-8-15)20-22-17-10-9-16(25(28)29)13-18(17)24(20)27/h5-10,13,27H,3-4,11-12H2,1-2H3,(H,21,26)