methyl 4-[[(2S)-3-(4-hydroxyphenyl)-1-oxidanylidene-1-(pentylamino)propan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[(2S)-3-(4-hydroxyphenyl)-1-oxidanylidene-1-(pentylamino)propan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[[(1S)-1-[(4-hydroxyphenyl)methyl]-2-oxo-2-(pentylamino)ethyl]amino]-4-oxo-butanoate CAS Name: 4-[[(2S)-3-(4-hydroxyphenyl)-1-oxo-1-(pentylamino)propan-2-yl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-3-(4-hydroxyphenyl)-1-oxo-1-(pentylamino)propan-2-yl]amino]-4-oxobutanoate Traditional Name: 4-[[(1S)-2-(amylamino)-1-(4-hydroxybenzyl)-2-keto-ethyl]amino]-4-keto-butyric acid methyl ester Formula: C19H28N2O5 MolecularWeight: 364.43602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCNC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)CCC(=O)OC

InChI

InChI=1S/C19H28N2O5/c1-3-4-5-12-20-19(25)16(13-14-6-8-15(22)9-7-14)21-17(23)10-11-18(24)26-2/h6-9,16,22H,3-5,10-13H2,1-2H3,(H,20,25)(H,21,23)/t16-/m0/s1