N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-1-(4-nitrophenyl)cyclopentane-1-carboxamide

Systemtic Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-1-(4-nitrophenyl)cyclopentane-1-carboxamide Openeye Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-1-(4-nitrophenyl)cyclopentanecarboxamide CAS Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-1-(4-nitrophenyl)-1-cyclopentanecarboxamide IUPAC Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-1-(4-nitrophenyl)cyclopentane-1-carboxamide Traditional Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-1-(4-nitrophenyl)cyclopentanecarboxamide Formula: C26H23N3O4S MolecularWeight: 473.54352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4(CCCC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4(CCCC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H23N3O4S/c1-33-22-13-8-17(24-27-20-6-2-3-7-23(20)34-24)16-21(22)28-25(30)26(14-4-5-15-26)18-9-11-19(12-10-18)29(31)32/h2-3,6-13,16H,4-5,14-15H2,1H3,(H,28,30)