[6-chloranyl-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: [6-chloranyl-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: (3-benzyl-6-chloro-4-methyl-2-oxo-chromen-7-yl) 2-(tert-butoxycarbonylamino)pentanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid [6-chloro-4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl] ester IUPAC Name: (3-benzyl-6-chloro-4-methyl-2-oxochromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: 2-(tert-butoxycarbonylamino)valeric acid (3-benzyl-6-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C27H30ClNO6 MolecularWeight: 499.9832

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)CC3=CC=CC=C3)C)Cl)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC(C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)CC3=CC=CC=C3)C)Cl)NC(=O)OC(C)(C)C

InChI

InChI=1S/C27H30ClNO6/c1-6-10-21(29-26(32)35-27(3,4)5)25(31)34-23-15-22-18(14-20(23)28)16(2)19(24(30)33-22)13-17-11-8-7-9-12-17/h7-9,11-12,14-15,21H,6,10,13H2,1-5H3,(H,29,32)