2-azanyl-5-oxidanyl-3-(phenylmethyl)-2-propanoyl-4-propyl-decanoic acid

Systemtic Name: 2-azanyl-5-oxidanyl-3-(phenylmethyl)-2-propanoyl-4-propyl-decanoic acid Openeye Name: 2-amino-3-benzyl-5-hydroxy-2-propanoyl-4-propyl-decanoic acid CAS Name: 2-amino-5-hydroxy-2-(1-oxopropyl)-3-(phenylmethyl)-4-propyldecanoic acid IUPAC Name: 2-amino-3-benzyl-5-hydroxy-2-propanoyl-4-propyldecanoic acid Traditional Name: 2-amino-3-benzyl-5-hydroxy-2-propionyl-4-propyl-capric acid Formula: C23H37NO4 MolecularWeight: 391.54418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(CCC)C(CC1=CC=CC=C1)C(C(=O)CC)(C(=O)O)N)O

Isomeric SMILES

CCCCCC(C(CCC)C(CC1=CC=CC=C1)C(C(=O)CC)(C(=O)O)N)O

InChI

InChI=1S/C23H37NO4/c1-4-7-9-15-20(25)18(12-5-2)19(16-17-13-10-8-11-14-17)23(24,22(27)28)21(26)6-3/h8,10-11,13-14,18-20,25H,4-7,9,12,15-16,24H2,1-3H3,(H,27,28)