N-[4-[2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]phenyl]-3-nitro-benzamide

Systemtic Name: N-[4-[2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-oxidanylidene-ethoxy]phenyl]-3-nitro-benzamide Openeye Name: N-[4-[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethoxy]phenyl]-3-nitro-benzamide CAS Name: N-[4-[2-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-oxoethoxy]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-[2-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-oxoethoxy]phenyl]-3-nitrobenzamide Traditional Name: N-[4-[2-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethoxy]phenyl]-3-nitro-benzamide Formula: C24H23N3O5 MolecularWeight: 433.45652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)COC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)COC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O5/c1-4-12-26-16(2)13-22(17(26)3)23(28)15-32-21-10-8-19(9-11-21)25-24(29)18-6-5-7-20(14-18)27(30)31/h4-11,13-14H,1,12,15H2,2-3H3,(H,25,29)