tert-butyl 7-aminocarbonyl-2-[2-(2-oxidanylphenoxy)ethylamino]-1-propyl-3H-indole-2-carboxylate

Systemtic Name: tert-butyl 7-aminocarbonyl-2-[2-(2-oxidanylphenoxy)ethylamino]-1-propyl-3H-indole-2-carboxylate Openeye Name: tert-butyl 7-carbamoyl-2-[2-(2-hydroxyphenoxy)ethylamino]-1-propyl-indoline-2-carboxylate CAS Name: 7-carbamoyl-2-[2-(2-hydroxyphenoxy)ethylamino]-1-propyl-3H-indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-carbamoyl-2-[2-(2-hydroxyphenoxy)ethylamino]-1-propyl-3H-indole-2-carboxylate Traditional Name: 7-carbamoyl-2-[2-(2-hydroxyphenoxy)ethylamino]-1-propyl-indoline-2-carboxylic acid tert-butyl ester Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC=C2CC1(C(=O)OC(C)(C)C)NCCOC3=CC=CC=C3O)C(=O)N

Isomeric SMILES

CCCN1C2=C(C=CC=C2CC1(C(=O)OC(C)(C)C)NCCOC3=CC=CC=C3O)C(=O)N

InChI

InChI=1S/C25H33N3O5/c1-5-14-28-21-17(9-8-10-18(21)22(26)30)16-25(28,23(31)33-24(2,3)4)27-13-15-32-20-12-7-6-11-19(20)29/h6-12,27,29H,5,13-16H2,1-4H3,(H2,26,30)