3-acetamido-4-[2-[2-[[1-azanyl-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]amino]ethanoyl]pyrrolidin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: 3-acetamido-4-[2-[2-[[1-azanyl-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]amino]ethanoyl]pyrrolidin-1-yl]-4-oxidanylidene-butanamide Openeye Name: 3-acetamido-4-[2-[2-[[2-amino-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]amino]acetyl]pyrrolidin-1-yl]-4-oxo-butanamide CAS Name: 3-acetamido-4-[2-[2-[[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxoethyl]-1-pyrrolidinyl]-4-oxobutanamide IUPAC Name: 3-acetamido-4-[2-[2-[[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]acetyl]pyrrolidin-1-yl]-4-oxobutanamide Traditional Name: 3-acetamido-4-[2-[2-[[2-amino-1-(4-hydroxybenzyl)-2-keto-ethyl]amino]acetyl]pyrrolidino]-4-keto-butyramide Formula: C21H29N5O6 MolecularWeight: 447.48486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N)C(=O)N1CCCC1C(=O)CNC(CC2=CC=C(C=C2)O)C(=O)N

Isomeric SMILES

CC(=O)NC(CC(=O)N)C(=O)N1CCCC1C(=O)CNC(CC2=CC=C(C=C2)O)C(=O)N

InChI

InChI=1S/C21H29N5O6/c1-12(27)25-16(10-19(22)30)21(32)26-8-2-3-17(26)18(29)11-24-15(20(23)31)9-13-4-6-14(28)7-5-13/h4-7,15-17,24,28H,2-3,8-11H2,1H3,(H2,22,30)(H2,23,31)(H,25,27)