[4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 4-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: [4,8-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 4-(phenylmethoxycarbonylamino)butanoate Openeye Name: (3-benzyl-4,8-dimethyl-2-oxo-chromen-7-yl) 4-(benzyloxycarbonylamino)butanoate CAS Name: 4-(phenylmethoxycarbonylamino)butanoic acid [4,8-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-4,8-dimethyl-2-oxochromen-7-yl) 4-(phenylmethoxycarbonylamino)butanoate Traditional Name: 4-(benzyloxycarbonylamino)butyric acid (3-benzyl-2-keto-4,8-dimethyl-chromen-7-yl) ester Formula: C30H29NO6 MolecularWeight: 499.55436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(=O)CCCNC(=O)OCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(=O)CCCNC(=O)OCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

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