[2-[2-(3-azanylpentan-3-yl)imidazol-1-yl]-5-nitro-phenyl]-(2-chlorophenyl)methanone

Systemtic Name: [2-[2-(3-azanylpentan-3-yl)imidazol-1-yl]-5-nitro-phenyl]-(2-chlorophenyl)methanone Openeye Name: [2-[2-(1-amino-1-ethyl-propyl)imidazol-1-yl]-5-nitro-phenyl]-(2-chlorophenyl)methanone CAS Name: [2-[2-(3-aminopentan-3-yl)-1-imidazolyl]-5-nitrophenyl]-(2-chlorophenyl)methanone IUPAC Name: [2-[2-(3-aminopentan-3-yl)imidazol-1-yl]-5-nitrophenyl]-(2-chlorophenyl)methanone Traditional Name: [2-[2-(1-amino-1-ethyl-propyl)imidazol-1-yl]-5-nitro-phenyl]-(2-chlorophenyl)methanone Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=NC=CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl)N

Isomeric SMILES

CCC(CC)(C1=NC=CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3Cl)N

InChI

InChI=1S/C21H21ClN4O3/c1-3-21(23,4-2)20-24-11-12-25(20)18-10-9-14(26(28)29)13-16(18)19(27)15-7-5-6-8-17(15)22/h5-13H,3-4,23H2,1-2H3