(phenylmethyl) (3S)-4-oxidanylidene-4-[(2-oxidanylidene-3,4-dihydrochromen-3-yl)amino]-3-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (phenylmethyl) (3S)-4-oxidanylidene-4-[(2-oxidanylidene-3,4-dihydrochromen-3-yl)amino]-3-(phenylmethoxycarbonylamino)butanoate Openeye Name: benzyl (3S)-3-(benzyloxycarbonylamino)-4-oxo-4-[(2-oxochroman-3-yl)amino]butanoate CAS Name: (3S)-4-oxo-4-[(2-oxo-3,4-dihydro-2H-1-benzopyran-3-yl)amino]-3-(phenylmethoxycarbonylamino)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-4-oxo-4-[(2-oxo-3,4-dihydrochromen-3-yl)amino]-3-(phenylmethoxycarbonylamino)butanoate Traditional Name: (3S)-3-(benzyloxycarbonylamino)-4-keto-4-[(2-ketochroman-3-yl)amino]butyric acid benzyl ester Formula: C28H26N2O7 MolecularWeight: 502.51524

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)OC2=CC=CC=C21)NC(=O)C(CC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)OC2=CC=CC=C21)NC(=O)[C@H](CC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H26N2O7/c31-25(35-17-19-9-3-1-4-10-19)16-22(30-28(34)36-18-20-11-5-2-6-12-20)26(32)29-23-15-21-13-7-8-14-24(21)37-27(23)33/h1-14,22-23H,15-18H2,(H,29,32)(H,30,34)/t22-,23?/m0/s1