4-(4-ethylphenyl)carbonyl-1-[4-(3-piperidin-1-ylpropoxy)phenyl]piperazin-2-one

Systemtic Name: 4-(4-ethylphenyl)carbonyl-1-[4-(3-piperidin-1-ylpropoxy)phenyl]piperazin-2-one Openeye Name: 4-(4-ethylbenzoyl)-1-[4-[3-(1-piperidyl)propoxy]phenyl]piperazin-2-one CAS Name: 4-[(4-ethylphenyl)-oxomethyl]-1-[4-[3-(1-piperidinyl)propoxy]phenyl]-2-piperazinone IUPAC Name: 4-(4-ethylbenzoyl)-1-[4-(3-piperidin-1-ylpropoxy)phenyl]piperazin-2-one Traditional Name: 4-(4-ethylbenzoyl)-1-[4-(3-piperidinopropoxy)phenyl]piperazin-2-one Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(C(=O)C2)C3=CC=C(C=C3)OCCCN4CCCCC4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(C(=O)C2)C3=CC=C(C=C3)OCCCN4CCCCC4

InChI

InChI=1S/C27H35N3O3/c1-2-22-7-9-23(10-8-22)27(32)29-18-19-30(26(31)21-29)24-11-13-25(14-12-24)33-20-6-17-28-15-4-3-5-16-28/h7-14H,2-6,15-21H2,1H3