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

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 4-(phenylmethoxycarbonylamino)butanoate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) 4-(benzyloxycarbonylamino)butanoate CAS Name: 4-(phenylmethoxycarbonylamino)butanoic acid [4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl] ester IUPAC Name: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) 4-(phenylmethoxycarbonylamino)butanoate Traditional Name: 4-(benzyloxycarbonylamino)butyric acid (3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C30H29NO6 MolecularWeight: 499.55436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H29NO6/c1-20-16-25(36-27(32)14-9-15-31-30(34)35-19-23-12-7-4-8-13-23)28-21(2)24(29(33)37-26(28)17-20)18-22-10-5-3-6-11-22/h3-8,10-13,16-17H,9,14-15,18-19H2,1-2H3,(H,31,34)