2-[2-[[(4S)-5-methoxy-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pentyl]amino]-2-oxidanylidene-ethyl]benzoic acid

Systemtic Name: 2-[2-[[(4S)-5-methoxy-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pentyl]amino]-2-oxidanylidene-ethyl]benzoic acid Openeye Name: 2-[2-[[(4S)-4-(benzyloxycarbonylamino)-5-methoxy-5-oxo-pentyl]amino]-2-oxo-ethyl]benzoic acid CAS Name: 2-[2-[[(4S)-5-methoxy-5-oxo-4-(phenylmethoxycarbonylamino)pentyl]amino]-2-oxoethyl]benzoic acid IUPAC Name: 2-[2-[[(4S)-5-methoxy-5-oxo-4-(phenylmethoxycarbonylamino)pentyl]amino]-2-oxoethyl]benzoic acid Traditional Name: 2-[2-[[(4S)-4-(benzyloxycarbonylamino)-5-keto-5-methoxy-pentyl]amino]-2-keto-ethyl]benzoic acid Formula: C23H26N2O7 MolecularWeight: 442.46174

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCNC(=O)CC1=CC=CC=C1C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@H](CCCNC(=O)CC1=CC=CC=C1C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H26N2O7/c1-31-22(29)19(25-23(30)32-15-16-8-3-2-4-9-16)12-7-13-24-20(26)14-17-10-5-6-11-18(17)21(27)28/h2-6,8-11,19H,7,12-15H2,1H3,(H,24,26)(H,25,30)(H,27,28)/t19-/m0/s1