N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-3-propan-2-yloxy-benzamide

Systemtic Name: N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-3-propan-2-yloxy-benzamide Openeye Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-3-isopropoxy-benzamide CAS Name: N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]-3-propan-2-yloxybenzamide IUPAC Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]-3-propan-2-yloxybenzamide Traditional Name: N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]-3-isopropoxy-benzamide Formula: C25H32ClN3O3 MolecularWeight: 457.99288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32ClN3O3/c1-17(2)14-24(30)29-12-10-28(11-13-29)23-9-8-20(16-22(23)26)27-25(31)19-6-5-7-21(15-19)32-18(3)4/h5-9,15-18H,10-14H2,1-4H3,(H,27,31)