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

Systemtic Name: [4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (3-benzyl-4-methyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid [4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-4-methyl-2-oxochromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-butyric acid (3-benzyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C30H29NO6 MolecularWeight: 499.55436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C30H29NO6/c1-19(2)27(31-30(34)35-18-22-12-8-5-9-13-22)29(33)36-23-14-15-24-20(3)25(28(32)37-26(24)17-23)16-21-10-6-4-7-11-21/h4-15,17,19,27H,16,18H2,1-3H3,(H,31,34)