3-[4-(3-acetyloxypropyl)piperazin-1-yl]propyl ethanoate; ethylbenzene

Systemtic Name: 3-[4-(3-acetyloxypropyl)piperazin-1-yl]propyl ethanoate; ethylbenzene Openeye Name: 3-[4-(3-acetoxypropyl)piperazin-1-yl]propyl acetate; ethylbenzene CAS Name: acetic acid 3-[4-(3-acetyloxypropyl)-1-piperazinyl]propyl ester; ethylbenzene IUPAC Name: 3-[4-(3-acetyloxypropyl)piperazin-1-yl]propyl acetate; ethylbenzene Traditional Name: acetic acid 3-[4-(3-acetoxypropyl)piperazino]propyl ester; ethylbenzene Formula: C22H36N2O4 MolecularWeight: 392.53224

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1.CC(=O)OCCCN1CCN(CC1)CCCOC(=O)C

Isomeric SMILES

CCC1=CC=CC=C1.CC(=O)OCCCN1CCN(CC1)CCCOC(=O)C

InChI

InChI=1S/C14H26N2O4.C8H10/c1-13(17)19-11-3-5-15-7-9-16(10-8-15)6-4-12-20-14(2)18;1-2-8-6-4-3-5-7-8/h3-12H2,1-2H3;3-7H,2H2,1H3