(3-methyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) 2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (3-methyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) 2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) 2-(benzyloxycarbonylamino)butanoate CAS Name: 2-(phenylmethoxycarbonylamino)butanoic acid (3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-1-yl) ester IUPAC Name: (3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) 2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)butyric acid (6-keto-3-methyl-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl) ester Formula: C26H27NO6 MolecularWeight: 449.49568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=CC(=CC2=C1C3=C(CCCC3)C(=O)O2)C)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)OC1=CC(=CC2=C1C3=C(CCCC3)C(=O)O2)C)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H27NO6/c1-3-20(27-26(30)31-15-17-9-5-4-6-10-17)25(29)33-22-14-16(2)13-21-23(22)18-11-7-8-12-19(18)24(28)32-21/h4-6,9-10,13-14,20H,3,7-8,11-12,15H2,1-2H3,(H,27,30)