methyl 7-(3-acetyloxypropoxy)-4-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 7-(3-acetyloxypropoxy)-4-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indole-2-carboxylate Openeye Name: methyl 7-(3-acetoxypropoxy)-5-(tert-butoxycarbonylamino)-4-methyl-1H-indole-2-carboxylate CAS Name: 7-(3-acetyloxypropoxy)-4-methyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 7-(3-acetyloxypropoxy)-4-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indole-2-carboxylate Traditional Name: 7-(3-acetoxypropoxy)-5-(tert-butoxycarbonylamino)-4-methyl-1H-indole-2-carboxylic acid methyl ester Formula: C21H28N2O7 MolecularWeight: 420.45622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(NC2=C(C=C1NC(=O)OC(C)(C)C)OCCCOC(=O)C)C(=O)OC

Isomeric SMILES

CC1=C2C=C(NC2=C(C=C1NC(=O)OC(C)(C)C)OCCCOC(=O)C)C(=O)OC

InChI

InChI=1S/C21H28N2O7/c1-12-14-10-16(19(25)27-6)22-18(14)17(29-9-7-8-28-13(2)24)11-15(12)23-20(26)30-21(3,4)5/h10-11,22H,7-9H2,1-6H3,(H,23,26)