(8-methoxy-4-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (8-methoxy-4-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (8-methoxy-4-methyl-6-oxo-benzo[c]chromen-3-yl) 2-(benzyloxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: 4-(methylthio)-2-(phenylmethoxycarbonylamino)butanoic acid (8-methoxy-4-methyl-6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (8-methoxy-4-methyl-6-oxobenzo[c]chromen-3-yl) 4-methylsulfanyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-4-(methylthio)butyric acid (6-keto-8-methoxy-4-methyl-benzo[c]chromen-3-yl) ester Formula: C28H27NO7S MolecularWeight: 521.58148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C3=C2C=CC(=C3)OC)OC(=O)C(CCSC)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C3=C2C=CC(=C3)OC)OC(=O)C(CCSC)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H27NO7S/c1-17-24(12-11-21-20-10-9-19(33-2)15-22(20)26(30)36-25(17)21)35-27(31)23(13-14-37-3)29-28(32)34-16-18-7-5-4-6-8-18/h4-12,15,23H,13-14,16H2,1-3H3,(H,29,32)