N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-nitro-4-pyrrolidino-benzamide Formula: C24H30N6O3 MolecularWeight: 450.5334

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H30N6O3/c1-3-27(4-2)15-16-29-20-10-6-5-9-19(20)25-24(29)26-23(31)18-11-12-21(22(17-18)30(32)33)28-13-7-8-14-28/h5-6,9-12,17H,3-4,7-8,13-16H2,1-2H3,(H,25,26,31)