2-(5-chloranyl-2-phenethyloxy-phenoxy)-2-oxidanylidene-ethanoic acid; 1-(2-methoxyphenyl)-4-propyl-piperazine

Systemtic Name: 2-(5-chloranyl-2-phenethyloxy-phenoxy)-2-oxidanylidene-ethanoic acid; 1-(2-methoxyphenyl)-4-propyl-piperazine Openeye Name: 2-(5-chloro-2-phenethyloxy-phenoxy)-2-oxo-acetic acid; 1-(2-methoxyphenyl)-4-propyl-piperazine CAS Name: 2-(5-chloro-2-phenethyloxyphenoxy)-2-oxoacetic acid; 1-(2-methoxyphenyl)-4-propylpiperazine IUPAC Name: 2-(5-chloro-2-phenethyloxyphenoxy)-2-oxoacetic acid; 1-(2-methoxyphenyl)-4-propylpiperazine Traditional Name: 2-(5-chloro-2-phenethyloxy-phenoxy)-2-keto-acetic acid; 1-(2-methoxyphenyl)-4-propyl-piperazine Formula: C30H35ClN2O6 MolecularWeight: 555.0617

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=CC=CC=C2OC.C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Cl)OC(=O)C(=O)O

Isomeric SMILES

CCCN1CCN(CC1)C2=CC=CC=C2OC.C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Cl)OC(=O)C(=O)O

InChI

InChI=1S/C16H13ClO5.C14H22N2O/c17-12-6-7-13(14(10-12)22-16(20)15(18)19)21-9-8-11-4-2-1-3-5-11;1-3-8-15-9-11-16(12-10-15)13-6-4-5-7-14(13)17-2/h1-7,10H,8-9H2,(H,18,19);4-7H,3,8-12H2,1-2H3