[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxidanylidene-chromen-7-yl] (2R)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxidanylidene-chromen-7-yl] (2R)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxo-chromen-7-yl] (2R)-2-(benzyloxycarbonylamino)-4-methyl-pentanoate CAS Name: (2R)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-oxochromen-7-yl] (2R)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2R)-2-(benzyloxycarbonylamino)-4-methyl-valeric acid [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-keto-2-methyl-chromen-7-yl] ester Formula: C32H31NO8 MolecularWeight: 557.59044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(CC(C)C)NC(=O)OCC3=CC=CC=C3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)[C@@H](CC(C)C)NC(=O)OCC3=CC=CC=C3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C32H31NO8/c1-19(2)15-25(33-32(36)39-18-21-7-5-4-6-8-21)31(35)41-23-10-11-24-27(17-23)40-20(3)29(30(24)34)22-9-12-26-28(16-22)38-14-13-37-26/h4-12,16-17,19,25H,13-15,18H2,1-3H3,(H,33,36)/t25-/m1/s1