N-chloranyl-2-(3-ethoxypiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethanamine

Systemtic Name: N-chloranyl-2-(3-ethoxypiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethanamine Openeye Name: N-chloro-2-(3-ethoxypiperazin-1-yl)-2-(4-isobutylphenyl)ethanamine CAS Name: N-chloro-2-(3-ethoxy-1-piperazinyl)-2-[4-(2-methylpropyl)phenyl]ethanamine IUPAC Name: N-chloro-2-(3-ethoxypiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethanamine Traditional Name: chloro-[2-(3-ethoxypiperazino)-2-(4-isobutylphenyl)ethyl]amine Formula: C18H30ClN3O MolecularWeight: 339.9033

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CN(CCN1)C(CNCl)C2=CC=C(C=C2)CC(C)C

Isomeric SMILES

CCOC1CN(CCN1)C(CNCl)C2=CC=C(C=C2)CC(C)C

InChI

InChI=1S/C18H30ClN3O/c1-4-23-18-13-22(10-9-20-18)17(12-21-19)16-7-5-15(6-8-16)11-14(2)3/h5-8,14,17-18,20-21H,4,9-13H2,1-3H3