methyl 4-[2-[[2-(1-benzofuran-2-yl)-2-oxidanyl-ethyl]amino]-2-methyl-propyl]benzoate

Systemtic Name: methyl 4-[2-[[2-(1-benzofuran-2-yl)-2-oxidanyl-ethyl]amino]-2-methyl-propyl]benzoate Openeye Name: methyl 4-[2-[[2-(benzofuran-2-yl)-2-hydroxy-ethyl]amino]-2-methyl-propyl]benzoate CAS Name: 4-[2-[[2-(2-benzofuranyl)-2-hydroxyethyl]amino]-2-methylpropyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-(1-benzofuran-2-yl)-2-hydroxyethyl]amino]-2-methylpropyl]benzoate Traditional Name: 4-[2-[[2-(benzofuran-2-yl)-2-hydroxy-ethyl]amino]-2-methyl-propyl]benzoic acid methyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)C(=O)OC)NCC(C2=CC3=CC=CC=C3O2)O

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)C(=O)OC)NCC(C2=CC3=CC=CC=C3O2)O

InChI

InChI=1S/C22H25NO4/c1-22(2,13-15-8-10-16(11-9-15)21(25)26-3)23-14-18(24)20-12-17-6-4-5-7-19(17)27-20/h4-12,18,23-24H,13-14H2,1-3H3