N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-])OC4CCCC4

InChI

InChI=1S/C22H22N4O5/c1-30-20-9-7-16(13-21(20)31-17-4-2-3-5-17)24-22(27)15-6-8-18(19(12-15)26(28)29)25-11-10-23-14-25/h6-14,17H,2-5H2,1H3,(H,24,27)