2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol; (E)-3-naphthalen-1-ylprop-2-enoic acid

Systemtic Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol; (E)-3-naphthalen-1-ylprop-2-enoic acid Openeye Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol; (E)-3-(1-naphthyl)prop-2-enoic acid CAS Name: 2-[4-(4-chlorophenyl)-1-piperazinyl]ethanol; (E)-3-(1-naphthalenyl)-2-propenoic acid IUPAC Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]ethanol; (E)-3-naphthalen-1-ylprop-2-enoic acid Traditional Name: 2-[4-(4-chlorophenyl)piperazino]ethanol; (E)-3-(1-naphthyl)acrylic acid Formula: C25H27ClN2O3 MolecularWeight: 438.94648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=CC=C(C=C2)Cl.C1=CC=C2C(=C1)C=CC=C2C=CC(=O)O

Isomeric SMILES

C1CN(CCN1CCO)C2=CC=C(C=C2)Cl.C1=CC=C2C(=C1)C=CC=C2/C=C/C(=O)O

InChI

InChI=1S/C13H10O2.C12H17ClN2O/c14-13(15)9-8-11-6-3-5-10-4-1-2-7-12(10)11;13-11-1-3-12(4-2-11)15-7-5-14(6-8-15)9-10-16/h1-9H,(H,14,15);1-4,16H,5-10H2/b9-8+;