4-(3-iodanylpiperazin-1-yl)-3-(2-methylpropyl)phenol

Systemtic Name: 4-(3-iodanylpiperazin-1-yl)-3-(2-methylpropyl)phenol Openeye Name: 4-(3-iodopiperazin-1-yl)-3-isobutyl-phenol CAS Name: 4-(3-iodo-1-piperazinyl)-3-(2-methylpropyl)phenol IUPAC Name: 4-(3-iodopiperazin-1-yl)-3-(2-methylpropyl)phenol Traditional Name: 4-(3-iodopiperazino)-3-isobutyl-phenol Formula: C14H21IN2O MolecularWeight: 360.23381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1)O)N2CCNC(C2)I

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1)O)N2CCNC(C2)I

InChI

InChI=1S/C14H21IN2O/c1-10(2)7-11-8-12(18)3-4-13(11)17-6-5-16-14(15)9-17/h3-4,8,10,14,16,18H,5-7,9H2,1-2H3