N-[3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidino-benzamide Formula: C26H24N4O5 MolecularWeight: 472.49256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C3C=C(C=CC3=O)NC(=O)C4=CC(=C(C=C4)N5CCCC5)[N+](=O)[O-])N2

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C3C=C(C=CC3=O)NC(=O)C4=CC(=C(C=C4)N5CCCC5)[N+](=O)[O-])N2

InChI

InChI=1S/C26H24N4O5/c1-2-16-5-10-24-20(13-16)28-26(35-24)19-15-18(7-9-23(19)31)27-25(32)17-6-8-21(22(14-17)30(33)34)29-11-3-4-12-29/h5-10,13-15,28H,2-4,11-12H2,1H3,(H,27,32)