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

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 3-(phenylmethoxycarbonylamino)propanoate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) 3-(benzyloxycarbonylamino)propanoate CAS Name: 3-(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) 3-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(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)CCNC(=O)OCC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C29H27NO6/c1-19-15-24(35-26(31)13-14-30-29(33)34-18-22-11-7-4-8-12-22)27-20(2)23(28(32)36-25(27)16-19)17-21-9-5-3-6-10-21/h3-12,15-16H,13-14,17-18H2,1-2H3,(H,30,33)