(1-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (1-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (1-methyl-6-oxo-benzo[c]chromen-3-yl) 2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid (1-methyl-6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (1-methyl-6-oxobenzo[c]chromen-3-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-butyric acid (6-keto-1-methyl-benzo[c]chromen-3-yl) ester Formula: C27H25NO6 MolecularWeight: 459.4905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C3=CC=CC=C3C(=O)O2)OC(=O)C(C(C)C)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC2=C1C3=CC=CC=C3C(=O)O2)OC(=O)C(C(C)C)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H25NO6/c1-16(2)24(28-27(31)32-15-18-9-5-4-6-10-18)26(30)33-19-13-17(3)23-20-11-7-8-12-21(20)25(29)34-22(23)14-19/h4-14,16,24H,15H2,1-3H3,(H,28,31)