(2S)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)propanamide

Systemtic Name: (2S)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)propanamide Openeye Name: (2S)-N-(4-benzyloxyphenyl)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]propanamide CAS Name: (2S)-2-[4-(2-hydroxyphenyl)-1-piperazinyl]-N-(4-phenylmethoxyphenyl)propanamide IUPAC Name: (2S)-2-[4-(2-hydroxyphenyl)piperazin-1-yl]-N-(4-phenylmethoxyphenyl)propanamide Traditional Name: (2S)-N-(4-benzoxyphenyl)-2-[4-(2-hydroxyphenyl)piperazino]propionamide Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4O

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4O

InChI

InChI=1S/C26H29N3O3/c1-20(28-15-17-29(18-16-28)24-9-5-6-10-25(24)30)26(31)27-22-11-13-23(14-12-22)32-19-21-7-3-2-4-8-21/h2-14,20,30H,15-19H2,1H3,(H,27,31)/t20-/m0/s1