N-[2-[[4-(2-bromoethyl)phenyl]carbamoyl]phenyl]quinoline-3-carboxamide

Systemtic Name: N-[2-[[4-(2-bromoethyl)phenyl]carbamoyl]phenyl]quinoline-3-carboxamide Openeye Name: N-[2-[[4-(2-bromoethyl)phenyl]carbamoyl]phenyl]quinoline-3-carboxamide CAS Name: N-[2-[[4-(2-bromoethyl)anilino]-oxomethyl]phenyl]-3-quinolinecarboxamide IUPAC Name: N-[2-[[4-(2-bromoethyl)phenyl]carbamoyl]phenyl]quinoline-3-carboxamide Traditional Name: N-[2-[[4-(2-bromoethyl)phenyl]carbamoyl]phenyl]quinoline-3-carboxamide Formula: C25H20BrN3O2 MolecularWeight: 474.3492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)CCBr

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)CCBr

InChI

InChI=1S/C25H20BrN3O2/c26-14-13-17-9-11-20(12-10-17)28-25(31)21-6-2-4-8-23(21)29-24(30)19-15-18-5-1-3-7-22(18)27-16-19/h1-12,15-16H,13-14H2,(H,28,31)(H,29,30)