N-[(2S)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-oxidanyl-1-oxidanylidene-propan-2-yl]-1-phenyl-cyclopropane-1-carboxamide

Systemtic Name: N-[(2S)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-oxidanyl-1-oxidanylidene-propan-2-yl]-1-phenyl-cyclopropane-1-carboxamide Openeye Name: N-[(1S)-2-[4-(4-acetylphenyl)piperazin-1-yl]-1-(hydroxymethyl)-2-oxo-ethyl]-1-phenyl-cyclopropanecarboxamide CAS Name: N-[(2S)-1-[4-(4-acetylphenyl)-1-piperazinyl]-3-hydroxy-1-oxopropan-2-yl]-1-phenyl-1-cyclopropanecarboxamide IUPAC Name: N-[(2S)-1-[4-(4-acetylphenyl)piperazin-1-yl]-3-hydroxy-1-oxopropan-2-yl]-1-phenylcyclopropane-1-carboxamide Traditional Name: N-[(1S)-2-[4-(4-acetylphenyl)piperazino]-2-keto-1-methylol-ethyl]-1-phenyl-cyclopropanecarboxamide Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C(CO)NC(=O)C3(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)[C@H](CO)NC(=O)C3(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O4/c1-18(30)19-7-9-21(10-8-19)27-13-15-28(16-14-27)23(31)22(17-29)26-24(32)25(11-12-25)20-5-3-2-4-6-20/h2-10,22,29H,11-17H2,1H3,(H,26,32)/t22-/m0/s1