2-(4-methoxyphenyl)-4-(3-phenylpropyl)-2-(4-piperazin-1-ylphenyl)azetidin-3-one

Systemtic Name: 2-(4-methoxyphenyl)-4-(3-phenylpropyl)-2-(4-piperazin-1-ylphenyl)azetidin-3-one Openeye Name: 2-(4-methoxyphenyl)-4-(3-phenylpropyl)-2-(4-piperazin-1-ylphenyl)azetidin-3-one CAS Name: 2-(4-methoxyphenyl)-4-(3-phenylpropyl)-2-[4-(1-piperazinyl)phenyl]-3-azetidinone IUPAC Name: 2-(4-methoxyphenyl)-4-(3-phenylpropyl)-2-(4-piperazin-1-ylphenyl)azetidin-3-one Traditional Name: 2-(4-methoxyphenyl)-4-(3-phenylpropyl)-2-(4-piperazinophenyl)azetidin-3-one Formula: C29H33N3O2 MolecularWeight: 455.59122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(C(=O)C(N2)CCCC3=CC=CC=C3)C4=CC=C(C=C4)N5CCNCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2(C(=O)C(N2)CCCC3=CC=CC=C3)C4=CC=C(C=C4)N5CCNCC5

InChI

InChI=1S/C29H33N3O2/c1-34-26-16-12-24(13-17-26)29(23-10-14-25(15-11-23)32-20-18-30-19-21-32)28(33)27(31-29)9-5-8-22-6-3-2-4-7-22/h2-4,6-7,10-17,27,30-31H,5,8-9,18-21H2,1H3