3-[(2-methylpropan-2-yl)oxycarbonyl]-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonyl]-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid Openeye Name: 3-tert-butoxycarbonyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid CAS Name: 3-[(2-methylpropan-2-yl)oxy-oxomethyl]-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid IUPAC Name: 3-[(2-methylpropan-2-yl)oxycarbonyl]-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid Traditional Name: 3-tert-butoxycarbonyl-1,2,4,5-tetrahydro-3-benzazepine-7-carboxylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(CC1)C=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(CC1)C=C(C=C2)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-16(2,3)21-15(20)17-8-6-11-4-5-13(14(18)19)10-12(11)7-9-17/h4-5,10H,6-9H2,1-3H3,(H,18,19)