O1-(5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl) O4-(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate

Systemtic Name: O1-(5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl) O4-(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Openeye Name: O4-benzyl O1-(5-hydroxy-4-oxo-2-phenyl-chromen-7-yl) (2S)-2-(tert-butoxycarbonylamino)butanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanedioic acid O1-(5-hydroxy-4-oxo-2-phenyl-1-benzopyran-7-yl) ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-(5-hydroxy-4-oxo-2-phenylchromen-7-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)succinic acid O4-benzyl ester O1-(5-hydroxy-4-keto-2-phenyl-chromen-7-yl) ester Formula: C31H29NO9 MolecularWeight: 559.56326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=O)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)OCC1=CC=CC=C1)C(=O)OC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C31H29NO9/c1-31(2,3)41-30(37)32-22(16-27(35)38-18-19-10-6-4-7-11-19)29(36)39-21-14-23(33)28-24(34)17-25(40-26(28)15-21)20-12-8-5-9-13-20/h4-15,17,22,33H,16,18H2,1-3H3,(H,32,37)/t22-/m0/s1