N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-(3-methylphenoxy)propanamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-(3-methylphenoxy)propanamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-(3-methylphenoxy)propanamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-3-(3-methylphenoxy)propanamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-(3-methylphenoxy)propanamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-3-(3-methylphenoxy)propionamide Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)NC2=CC(=C(C=C2)N3CCNC(=O)C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)NC2=CC(=C(C=C2)N3CCNC(=O)C3)Cl

InChI

InChI=1S/C20H22ClN3O3/c1-14-3-2-4-16(11-14)27-10-7-19(25)23-15-5-6-18(17(21)12-15)24-9-8-22-20(26)13-24/h2-6,11-12H,7-10,13H2,1H3,(H,22,26)(H,23,25)