[6-chloranyl-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [6-chloranyl-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (3-benzyl-6-chloro-4-methyl-2-oxo-chromen-7-yl) 2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic 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) 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid (3-benzyl-6-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C34H28ClNO6 MolecularWeight: 582.04222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C34H28ClNO6/c1-22-26-19-28(35)31(20-30(26)41-32(37)27(22)17-23-11-5-2-6-12-23)42-33(38)29(18-24-13-7-3-8-14-24)36-34(39)40-21-25-15-9-4-10-16-25/h2-16,19-20,29H,17-18,21H2,1H3,(H,36,39)