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

Systemtic Name: (1-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (1-methyl-6-oxo-benzo[c]chromen-3-yl) (2S)-2-(benzyloxycarbonylamino)propanoate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)propanoic acid (1-methyl-6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (1-methyl-6-oxobenzo[c]chromen-3-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)propionic acid (6-keto-1-methyl-benzo[c]chromen-3-yl) ester Formula: C25H21NO6 MolecularWeight: 431.43734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21NO6/c1-15-12-18(13-21-22(15)19-10-6-7-11-20(19)24(28)32-21)31-23(27)16(2)26-25(29)30-14-17-8-4-3-5-9-17/h3-13,16H,14H2,1-2H3,(H,26,29)/t16-/m0/s1