3-[(2-methylpropan-2-yl)oxycarbonyl]-2,4,5,6-tetrahydro-1H-3-benzazocine-2-carboxylic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonyl]-2,4,5,6-tetrahydro-1H-3-benzazocine-2-carboxylic acid Openeye Name: 3-tert-butoxycarbonyl-2,4,5,6-tetrahydro-1H-3-benzazocine-2-carboxylic acid CAS Name: 3-[(2-methylpropan-2-yl)oxy-oxomethyl]-2,4,5,6-tetrahydro-1H-3-benzazocine-2-carboxylic acid IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonyl]-2,4,5,6-tetrahydro-1H-3-benzazocine-2-carboxylic acid Traditional Name: 3-tert-butoxycarbonyl-2,4,5,6-tetrahydro-1H-3-benzazocine-2-carboxylic acid Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC2=CC=CC=C2CC1C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC2=CC=CC=C2CC1C(=O)O

InChI

InChI=1S/C17H23NO4/c1-17(2,3)22-16(21)18-10-6-9-12-7-4-5-8-13(12)11-14(18)15(19)20/h4-5,7-8,14H,6,9-11H2,1-3H3,(H,19,20)