[4-[(2S)-2-(butanoylamino)-3-methoxy-3-oxidanylidene-propyl]phenyl] butanoate

Systemtic Name: [4-[(2S)-2-(butanoylamino)-3-methoxy-3-oxidanylidene-propyl]phenyl] butanoate Openeye Name: [4-[(2S)-2-(butanoylamino)-3-methoxy-3-oxo-propyl]phenyl] butanoate CAS Name: butanoic acid [4-[(2S)-3-methoxy-3-oxo-2-(1-oxobutylamino)propyl]phenyl] ester IUPAC Name: [4-[(2S)-2-(butanoylamino)-3-methoxy-3-oxopropyl]phenyl] butanoate Traditional Name: butyric acid [4-[(2S)-2-butyramido-3-keto-3-methoxy-propyl]phenyl] ester Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(CC1=CC=C(C=C1)OC(=O)CCC)C(=O)OC

Isomeric SMILES

CCCC(=O)N[C@@H](CC1=CC=C(C=C1)OC(=O)CCC)C(=O)OC

InChI

InChI=1S/C18H25NO5/c1-4-6-16(20)19-15(18(22)23-3)12-13-8-10-14(11-9-13)24-17(21)7-5-2/h8-11,15H,4-7,12H2,1-3H3,(H,19,20)/t15-/m0/s1