N-[3-(3-bromanylpropoxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]-3-phenyl-N-(3-phenylpropanoyl)propanamide

Systemtic Name: N-[3-(3-bromanylpropoxy)-4-chloranyl-1-oxidanylidene-isochromen-7-yl]-3-phenyl-N-(3-phenylpropanoyl)propanamide Openeye Name: N-[3-(3-bromopropoxy)-4-chloro-1-oxo-isochromen-7-yl]-3-phenyl-N-(3-phenylpropanoyl)propanamide CAS Name: N-[3-(3-bromopropoxy)-4-chloro-1-oxo-2-benzopyran-7-yl]-N-(1-oxo-3-phenylpropyl)-3-phenylpropanamide IUPAC Name: N-[3-(3-bromopropoxy)-4-chloro-1-oxoisochromen-7-yl]-3-phenyl-N-(3-phenylpropanoyl)propanamide Traditional Name: N-[3-(3-bromopropoxy)-4-chloro-1-keto-isochromen-7-yl]-N-hydrocinnamoyl-3-phenyl-propionamide Formula: C30H27BrClNO5 MolecularWeight: 596.89608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)N(C2=CC3=C(C=C2)C(=C(OC3=O)OCCCBr)Cl)C(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)N(C2=CC3=C(C=C2)C(=C(OC3=O)OCCCBr)Cl)C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C30H27BrClNO5/c31-18-7-19-37-30-28(32)24-15-14-23(20-25(24)29(36)38-30)33(26(34)16-12-21-8-3-1-4-9-21)27(35)17-13-22-10-5-2-6-11-22/h1-6,8-11,14-15,20H,7,12-13,16-19H2