N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-3-oxidanylidene-1-(4-propan-2-yloxyphenyl)prop-1-en-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-3-oxidanylidene-1-(4-propan-2-yloxyphenyl)prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(Z)-1-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-2-(4-isopropoxyphenyl)vinyl]-3-nitro-benzamide CAS Name: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-3-oxo-1-(4-propan-2-yloxyphenyl)prop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-3-oxo-1-(4-propan-2-yloxyphenyl)prop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(Z)-1-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-2-(4-isopropoxyphenyl)vinyl]-3-nitro-benzamide Formula: C28H27N5O5 MolecularWeight: 513.54448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C=C(C(=O)NCCC2=NC3=CC=CC=C3N2)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)/C=C(/C(=O)NCCC2=NC3=CC=CC=C3N2)\NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H27N5O5/c1-18(2)38-22-12-10-19(11-13-22)16-25(32-27(34)20-6-5-7-21(17-20)33(36)37)28(35)29-15-14-26-30-23-8-3-4-9-24(23)31-26/h3-13,16-18H,14-15H2,1-2H3,(H,29,35)(H,30,31)(H,32,34)/b25-16-