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

Systemtic Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-cyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxo-1-cyclohexa-1,5-dienyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-5-methyl-4-oxocyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[3-(3H-1,3-benzoxazol-2-ylidene)-4-keto-5-methyl-cyclohexa-1,5-dien-1-yl]-3-nitro-4-pyrrolidino-benzamide Formula: C25H22N4O5 MolecularWeight: 458.46598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C2NC3=CC=CC=C3O2)C1=O)NC(=O)C4=CC(=C(C=C4)N5CCCC5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C2NC3=CC=CC=C3O2)C1=O)NC(=O)C4=CC(=C(C=C4)N5CCCC5)[N+](=O)[O-]

InChI

InChI=1S/C25H22N4O5/c1-15-12-17(14-18(23(15)30)25-27-19-6-2-3-7-22(19)34-25)26-24(31)16-8-9-20(21(13-16)29(32)33)28-10-4-5-11-28/h2-3,6-9,12-14,27H,4-5,10-11H2,1H3,(H,26,31)