(2S)-2-[2-(4-bromanyl-5-methanoyl-2-methoxy-phenoxy)ethanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[2-(4-bromanyl-5-methanoyl-2-methoxy-phenoxy)ethanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[2-(4-bromo-5-formyl-2-methoxy-phenoxy)acetyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[2-(4-bromo-5-formyl-2-methoxyphenoxy)-1-oxoethyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[2-(4-bromo-5-formyl-2-methoxyphenoxy)acetyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[2-(4-bromo-5-formyl-2-methoxy-phenoxy)acetyl]amino]-N-ethyl-propionamide Formula: C15H19BrN2O5 MolecularWeight: 387.22576

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)COC1=C(C=C(C(=C1)C=O)Br)OC

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)COC1=C(C=C(C(=C1)C=O)Br)OC

InChI

InChI=1S/C15H19BrN2O5/c1-4-17-15(21)9(2)18-14(20)8-23-13-5-10(7-19)11(16)6-12(13)22-3/h5-7,9H,4,8H2,1-3H3,(H,17,21)(H,18,20)/t9-/m0/s1