N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-1-(4-nitrophenyl)cyclopentane-1-carboxamide

Systemtic Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-1-(4-nitrophenyl)cyclopentane-1-carboxamide Openeye Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]-1-(4-nitrophenyl)cyclopentanecarboxamide CAS Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]-1-(4-nitrophenyl)-1-cyclopentanecarboxamide IUPAC Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-1-(4-nitrophenyl)cyclopentane-1-carboxamide Traditional Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]-1-(4-nitrophenyl)cyclopentanecarboxamide Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C4NC5=CC=CC=C5O4)C(=O)C=C3

Isomeric SMILES

C1CCC(C1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C4NC5=CC=CC=C5O4)C(=O)C=C3

InChI

InChI=1S/C25H21N3O5/c29-21-12-9-17(15-19(21)23-27-20-5-1-2-6-22(20)33-23)26-24(30)25(13-3-4-14-25)16-7-10-18(11-8-16)28(31)32/h1-2,5-12,15,27H,3-4,13-14H2,(H,26,30)