7-methoxy-5,7-bis(oxidanylidene)-2-(phenylmethoxycarbonylamino)heptanoic acid

Systemtic Name: 7-methoxy-5,7-bis(oxidanylidene)-2-(phenylmethoxycarbonylamino)heptanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-7-methoxy-5,7-dioxo-heptanoic acid CAS Name: 7-methoxy-5,7-dioxo-2-(phenylmethoxycarbonylamino)heptanoic acid IUPAC Name: 7-methoxy-5,7-dioxo-2-(phenylmethoxycarbonylamino)heptanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-5,7-diketo-7-methoxy-enanthic acid Formula: C16H19NO7 MolecularWeight: 337.32456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CC(=O)CCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H19NO7/c1-23-14(19)9-12(18)7-8-13(15(20)21)17-16(22)24-10-11-5-3-2-4-6-11/h2-6,13H,7-10H2,1H3,(H,17,22)(H,20,21)