3-[(E)-3-(1H-benzimidazol-2-yl)prop-2-enoyl]-6-bromanyl-4-phenyl-1H-quinolin-2-one

Systemtic Name: 3-[(E)-3-(1H-benzimidazol-2-yl)prop-2-enoyl]-6-bromanyl-4-phenyl-1H-quinolin-2-one Openeye Name: 3-[(E)-3-(1H-benzimidazol-2-yl)prop-2-enoyl]-6-bromo-4-phenyl-1H-quinolin-2-one CAS Name: 3-[(E)-3-(1H-benzimidazol-2-yl)-1-oxoprop-2-enyl]-6-bromo-4-phenyl-1H-quinolin-2-one IUPAC Name: 3-[(E)-3-(1H-benzimidazol-2-yl)prop-2-enoyl]-6-bromo-4-phenyl-1H-quinolin-2-one Traditional Name: 3-[(E)-3-(1H-benzimidazol-2-yl)acryloyl]-6-bromo-4-phenyl-carbostyril Formula: C25H16BrN3O2 MolecularWeight: 470.31744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Br)C(=O)C=CC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Br)C(=O)/C=C/C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H16BrN3O2/c26-16-10-11-18-17(14-16)23(15-6-2-1-3-7-15)24(25(31)29-18)21(30)12-13-22-27-19-8-4-5-9-20(19)28-22/h1-14H,(H,27,28)(H,29,31)/b13-12+