(4S)-5-oxidanylidene-4-[(4-phenylpyridin-2-yl)carbonylamino]-5-(4-propanoyloxypiperazin-1-yl)pentanoic acid

Systemtic Name: (4S)-5-oxidanylidene-4-[(4-phenylpyridin-2-yl)carbonylamino]-5-(4-propanoyloxypiperazin-1-yl)pentanoic acid Openeye Name: (4S)-5-oxo-4-[(4-phenylpyridine-2-carbonyl)amino]-5-(4-propanoyloxypiperazin-1-yl)pentanoic acid CAS Name: (4S)-5-oxo-4-[[oxo-(4-phenyl-2-pyridinyl)methyl]amino]-5-[4-(1-oxopropoxy)-1-piperazinyl]pentanoic acid IUPAC Name: (4S)-5-oxo-4-[(4-phenylpyridine-2-carbonyl)amino]-5-(4-propanoyloxypiperazin-1-yl)pentanoic acid Traditional Name: (4S)-5-keto-4-[(4-phenylpicolinoyl)amino]-5-(4-propionyloxypiperazino)valeric acid Formula: C24H28N4O6 MolecularWeight: 468.50232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=NC=CC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCC(=O)ON1CCN(CC1)C(=O)[C@H](CCC(=O)O)NC(=O)C2=NC=CC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H28N4O6/c1-2-22(31)34-28-14-12-27(13-15-28)24(33)19(8-9-21(29)30)26-23(32)20-16-18(10-11-25-20)17-6-4-3-5-7-17/h3-7,10-11,16,19H,2,8-9,12-15H2,1H3,(H,26,32)(H,29,30)/t19-/m0/s1