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

Systemtic Name: (1-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (1-methyl-6-oxo-benzo[c]chromen-3-yl) 2-(benzyloxycarbonylamino)pentanoate CAS Name: 2-(phenylmethoxycarbonylamino)pentanoic acid (1-methyl-6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (1-methyl-6-oxobenzo[c]chromen-3-yl) 2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)valeric 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:

CCCC(C(=O)OC1=CC2=C(C(=C1)C)C3=CC=CC=C3C(=O)O2)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)OC1=CC2=C(C(=C1)C)C3=CC=CC=C3C(=O)O2)NC(=O)OCC4=CC=CC=C4

InChI

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