[4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] (2S)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] (2S)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) (2S)-2-(benzyloxycarbonylamino)propanoate CAS Name: (2S)-2-(phenylmethoxycarbonylamino)propanoic acid [4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl] ester IUPAC Name: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2S)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)propionic acid (3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C29H27NO6 MolecularWeight: 485.52778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)C(C)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)[C@H](C)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H27NO6/c1-18-14-24(35-27(31)20(3)30-29(33)34-17-22-12-8-5-9-13-22)26-19(2)23(28(32)36-25(26)15-18)16-21-10-6-4-7-11-21/h4-15,20H,16-17H2,1-3H3,(H,30,33)/t20-/m0/s1