N-[(2S)-1-[(3-methoxyphenyl)amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-oxidanyl-5-pyrrol-1-yl-benzamide

Systemtic Name: N-[(2S)-1-[(3-methoxyphenyl)amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]-2-oxidanyl-5-pyrrol-1-yl-benzamide Openeye Name: 2-hydroxy-N-[(1S)-1-(hydroxymethyl)-2-(3-methoxyanilino)-2-oxo-ethyl]-5-pyrrol-1-yl-benzamide CAS Name: 2-hydroxy-N-[(2S)-3-hydroxy-1-(3-methoxyanilino)-1-oxopropan-2-yl]-5-(1-pyrrolyl)benzamide IUPAC Name: 2-hydroxy-N-[(2S)-3-hydroxy-1-(3-methoxyanilino)-1-oxopropan-2-yl]-5-pyrrol-1-ylbenzamide Traditional Name: 2-hydroxy-N-[(1S)-2-keto-2-(m-anisidino)-1-methylol-ethyl]-5-pyrrol-1-yl-benzamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(CO)NC(=O)C2=C(C=CC(=C2)N3C=CC=C3)O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)[C@H](CO)NC(=O)C2=C(C=CC(=C2)N3C=CC=C3)O

InChI

InChI=1S/C21H21N3O5/c1-29-16-6-4-5-14(11-16)22-21(28)18(13-25)23-20(27)17-12-15(7-8-19(17)26)24-9-2-3-10-24/h2-12,18,25-26H,13H2,1H3,(H,22,28)(H,23,27)/t18-/m0/s1