(4-butyl-7-methyl-2-oxidanylidene-chromen-5-yl) 3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: (4-butyl-7-methyl-2-oxidanylidene-chromen-5-yl) 3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (4-butyl-7-methyl-2-oxo-chromen-5-yl) 2-(tert-butoxycarbonylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (4-butyl-7-methyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (4-butyl-7-methyl-2-oxochromen-5-yl) 3-(1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(1H-indol-3-yl)propionic acid (4-butyl-2-keto-7-methyl-chromen-5-yl) ester Formula: C30H34N2O6 MolecularWeight: 518.60076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)OC(C)(C)C

InChI

InChI=1S/C30H34N2O6/c1-6-7-10-19-16-26(33)36-24-13-18(2)14-25(27(19)24)37-28(34)23(32-29(35)38-30(3,4)5)15-20-17-31-22-12-9-8-11-21(20)22/h8-9,11-14,16-17,23,31H,6-7,10,15H2,1-5H3,(H,32,35)