(1-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: (1-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: (1-methyl-6-oxo-benzo[c]chromen-3-yl) (2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoate CAS Name: (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid (1-methyl-6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (1-methyl-6-oxobenzo[c]chromen-3-yl) (2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-methyl-valeric acid (6-keto-1-methyl-benzo[c]chromen-3-yl) ester Formula: C28H27NO6 MolecularWeight: 473.51708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=CC2=C1C3=CC=CC=C3C(=O)O2)OC(=O)[C@H](CC(C)C)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H27NO6/c1-17(2)13-23(29-28(32)33-16-19-9-5-4-6-10-19)27(31)34-20-14-18(3)25-21-11-7-8-12-22(21)26(30)35-24(25)15-20/h4-12,14-15,17,23H,13,16H2,1-3H3,(H,29,32)/t23-/m0/s1