N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]butanamide

Systemtic Name: N-[3-chloranyl-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]butanamide Openeye Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]butanamide CAS Name: N-[3-chloro-4-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]phenyl]butanamide IUPAC Name: N-[3-chloro-4-[4-(3-methylbutanoyl)piperazin-1-yl]phenyl]butanamide Traditional Name: N-[3-chloro-4-(4-isovalerylpiperazino)phenyl]butyramide Formula: C19H28ClN3O2 MolecularWeight: 365.89752

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)CC(C)C)Cl

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(=O)CC(C)C)Cl

InChI

InChI=1S/C19H28ClN3O2/c1-4-5-18(24)21-15-6-7-17(16(20)13-15)22-8-10-23(11-9-22)19(25)12-14(2)3/h6-7,13-14H,4-5,8-12H2,1-3H3,(H,21,24)