ethyl 4-[2-(tert-butylamino)-1-oxidanyl-propyl]-7-oxidanyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 4-[2-(tert-butylamino)-1-oxidanyl-propyl]-7-oxidanyl-1H-indole-2-carboxylate Openeye Name: ethyl 4-[2-(tert-butylamino)-1-hydroxy-propyl]-7-hydroxy-1H-indole-2-carboxylate CAS Name: 4-[2-(tert-butylamino)-1-hydroxypropyl]-7-hydroxy-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(tert-butylamino)-1-hydroxypropyl]-7-hydroxy-1H-indole-2-carboxylate Traditional Name: 4-[2-(tert-butylamino)-1-hydroxy-propyl]-7-hydroxy-1H-indole-2-carboxylic acid ethyl ester Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=CC(=C2N1)O)C(C(C)NC(C)(C)C)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=CC(=C2N1)O)C(C(C)NC(C)(C)C)O

InChI

InChI=1S/C18H26N2O4/c1-6-24-17(23)13-9-12-11(7-8-14(21)15(12)19-13)16(22)10(2)20-18(3,4)5/h7-10,16,19-22H,6H2,1-5H3