N-[(2S)-1-[(4-fluorophenyl)methylamino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-oxidanyl-5-pyrrol-1-yl-benzamide

Systemtic Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-oxidanyl-5-pyrrol-1-yl-benzamide Openeye Name: N-[(1S)-2-[(4-fluorophenyl)methylamino]-1-(hydroxymethyl)-2-oxo-ethyl]-2-hydroxy-5-pyrrol-1-yl-benzamide CAS Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-3-hydroxy-1-oxopropan-2-yl]-2-hydroxy-5-(1-pyrrolyl)benzamide IUPAC Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-3-hydroxy-1-oxopropan-2-yl]-2-hydroxy-5-pyrrol-1-ylbenzamide Traditional Name: N-[(1S)-2-[(4-fluorobenzyl)amino]-2-keto-1-methylol-ethyl]-2-hydroxy-5-pyrrol-1-yl-benzamide Formula: C21H20FN3O4 MolecularWeight: 397.399603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC(=C(C=C2)O)C(=O)NC(CO)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1=CN(C=C1)C2=CC(=C(C=C2)O)C(=O)N[C@@H](CO)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O4/c22-15-5-3-14(4-6-15)12-23-21(29)18(13-26)24-20(28)17-11-16(7-8-19(17)27)25-9-1-2-10-25/h1-11,18,26-27H,12-13H2,(H,23,29)(H,24,28)/t18-/m0/s1