2-[4-(3-chloranylpiperazin-1-yl)-3-(2-methylpropyl)phenyl]phenol

Systemtic Name: 2-[4-(3-chloranylpiperazin-1-yl)-3-(2-methylpropyl)phenyl]phenol Openeye Name: 2-[4-(3-chloropiperazin-1-yl)-3-isobutyl-phenyl]phenol CAS Name: 2-[4-(3-chloro-1-piperazinyl)-3-(2-methylpropyl)phenyl]phenol IUPAC Name: 2-[4-(3-chloropiperazin-1-yl)-3-(2-methylpropyl)phenyl]phenol Traditional Name: 2-[4-(3-chloropiperazino)-3-isobutyl-phenyl]phenol Formula: C20H25ClN2O MolecularWeight: 344.8783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1)C2=CC=CC=C2O)N3CCNC(C3)Cl

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1)C2=CC=CC=C2O)N3CCNC(C3)Cl

InChI

InChI=1S/C20H25ClN2O/c1-14(2)11-16-12-15(17-5-3-4-6-19(17)24)7-8-18(16)23-10-9-22-20(21)13-23/h3-8,12,14,20,22,24H,9-11,13H2,1-2H3