N-[(2S)-1-(3-bicyclo[2.2.1]heptanylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-oxidanyl-5-pyrrol-1-yl-benzamide

Systemtic Name: N-[(2S)-1-(3-bicyclo[2.2.1]heptanylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-oxidanyl-5-pyrrol-1-yl-benzamide Openeye Name: 2-hydroxy-N-[(1S)-1-(hydroxymethyl)-2-(norbornan-2-ylamino)-2-oxo-ethyl]-5-pyrrol-1-yl-benzamide CAS Name: N-[(2S)-1-(3-bicyclo[2.2.1]heptanylamino)-3-hydroxy-1-oxopropan-2-yl]-2-hydroxy-5-(1-pyrrolyl)benzamide IUPAC Name: N-[(2S)-1-(3-bicyclo[2.2.1]heptanylamino)-3-hydroxy-1-oxopropan-2-yl]-2-hydroxy-5-pyrrol-1-ylbenzamide Traditional Name: 2-hydroxy-N-[(1S)-2-keto-1-methylol-2-(2-norbornylamino)ethyl]-5-pyrrol-1-yl-benzamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1CC2NC(=O)C(CO)NC(=O)C3=C(C=CC(=C3)N4C=CC=C4)O

Isomeric SMILES

C1CC2CC1CC2NC(=O)[C@H](CO)NC(=O)C3=C(C=CC(=C3)N4C=CC=C4)O

InChI

InChI=1S/C21H25N3O4/c25-12-18(21(28)22-17-10-13-3-4-14(17)9-13)23-20(27)16-11-15(5-6-19(16)26)24-7-1-2-8-24/h1-2,5-8,11,13-14,17-18,25-26H,3-4,9-10,12H2,(H,22,28)(H,23,27)/t13?,14?,17?,18-/m0/s1