2-oxidanylidene-13-(phenylmethoxycarbonylamino)tridecanoic acid

Systemtic Name: 2-oxidanylidene-13-(phenylmethoxycarbonylamino)tridecanoic acid Openeye Name: 13-(benzyloxycarbonylamino)-2-oxo-tridecanoic acid CAS Name: 2-oxo-13-(phenylmethoxycarbonylamino)tridecanoic acid IUPAC Name: 2-oxo-13-(phenylmethoxycarbonylamino)tridecanoic acid Traditional Name: 13-(benzyloxycarbonylamino)-2-keto-tridecanoic acid Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCCCCCCCCC(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCCCCCCCCC(=O)C(=O)O

InChI

InChI=1S/C21H31NO5/c23-19(20(24)25)15-11-6-4-2-1-3-5-7-12-16-22-21(26)27-17-18-13-9-8-10-14-18/h8-10,13-14H,1-7,11-12,15-17H2,(H,22,26)(H,24,25)