[4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) 2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid [4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl] ester IUPAC Name: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-butyric acid (3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C31H31NO6 MolecularWeight: 513.58094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)C(C(C)C)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)C(C(C)C)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H31NO6/c1-19(2)28(32-31(35)36-18-23-13-9-6-10-14-23)30(34)38-26-16-20(3)15-25-27(26)21(4)24(29(33)37-25)17-22-11-7-5-8-12-22/h5-16,19,28H,17-18H2,1-4H3,(H,32,35)