tert-butyl 7-carboxyoxy-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate

Systemtic Name: tert-butyl 7-carboxyoxy-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate Openeye Name: tert-butyl 7-carboxyoxy-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate CAS Name: 7-carboxyoxy-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-carboxyoxy-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate Traditional Name: 7-carboxyoxy-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylic acid tert-butyl ester Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO5/c1-16(2,3)22-14(18)17-8-6-11-4-5-13(21-15(19)20)10-12(11)7-9-17/h4-5,10H,6-9H2,1-3H3,(H,19,20)