4-[4-[(2,5-dimethylpyrrol-1-yl)carbamoyl]phenoxy]-3-nitro-benzamide

Systemtic Name: 4-[4-[(2,5-dimethylpyrrol-1-yl)carbamoyl]phenoxy]-3-nitro-benzamide Openeye Name: 4-[4-[(2,5-dimethylpyrrol-1-yl)carbamoyl]phenoxy]-3-nitro-benzamide CAS Name: 4-[4-[[(2,5-dimethyl-1-pyrrolyl)amino]-oxomethyl]phenoxy]-3-nitrobenzamide IUPAC Name: 4-[4-[(2,5-dimethylpyrrol-1-yl)carbamoyl]phenoxy]-3-nitrobenzamide Traditional Name: 4-[4-[(2,5-dimethylpyrrol-1-yl)carbamoyl]phenoxy]-3-nitro-benzamide Formula: C20H18N4O5 MolecularWeight: 394.38072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])C

InChI

InChI=1S/C20H18N4O5/c1-12-3-4-13(2)23(12)22-20(26)14-5-8-16(9-6-14)29-18-10-7-15(19(21)25)11-17(18)24(27)28/h3-11H,1-2H3,(H2,21,25)(H,22,26)