[4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate

Systemtic Name: [4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl] 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Openeye Name: (3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl) 6-(tert-butoxycarbonylamino)hexanoate CAS Name: 6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid [4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl] ester IUPAC Name: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Traditional Name: 6-(tert-butoxycarbonylamino)hexanoic acid (3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl) ester Formula: C29H35NO6 MolecularWeight: 493.5913

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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)CCCCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)CCCCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C29H35NO6/c1-19-16-23(34-25(31)14-10-7-11-15-30-28(33)36-29(3,4)5)26-20(2)22(27(32)35-24(26)17-19)18-21-12-8-6-9-13-21/h6,8-9,12-13,16-17H,7,10-11,14-15,18H2,1-5H3,(H,30,33)