(E)-N-[3-chloranyl-4-(4-propanoylpiperazin-1-yl)phenyl]-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[3-chloranyl-4-(4-propanoylpiperazin-1-yl)phenyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]-3-(4-isopropylphenyl)prop-2-enamide CAS Name: (E)-N-[3-chloro-4-[4-(1-oxopropyl)-1-piperazinyl]phenyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-[3-chloro-4-(4-propanoylpiperazin-1-yl)phenyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-[3-chloro-4-(4-propionylpiperazino)phenyl]-3-p-cumenyl-acrylamide Formula: C25H30ClN3O2 MolecularWeight: 439.9776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)C(C)C)Cl

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(C)C)Cl

InChI

InChI=1S/C25H30ClN3O2/c1-4-25(31)29-15-13-28(14-16-29)23-11-10-21(17-22(23)26)27-24(30)12-7-19-5-8-20(9-6-19)18(2)3/h5-12,17-18H,4,13-16H2,1-3H3,(H,27,30)/b12-7+