tert-butyl 8-(dimethylamino)-5-(2-methoxy-2-oxidanylidene-ethyl)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylate

Systemtic Name: tert-butyl 8-(dimethylamino)-5-(2-methoxy-2-oxidanylidene-ethyl)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylate Openeye Name: tert-butyl 8-(dimethylamino)-5-(2-methoxy-2-oxo-ethyl)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylate CAS Name: 8-(dimethylamino)-5-(2-methoxy-2-oxoethyl)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-(dimethylamino)-5-(2-methoxy-2-oxoethyl)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylate Traditional Name: 8-(dimethylamino)-5-(2-keto-2-methoxy-ethyl)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxylic acid tert-butyl ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C2=C(C1)C=C(C=C2)N(C)C)CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C2=C(C1)C=C(C=C2)N(C)C)CC(=O)OC

InChI

InChI=1S/C20H30N2O4/c1-20(2,3)26-19(24)22-10-9-14(12-18(23)25-6)17-8-7-16(21(4)5)11-15(17)13-22/h7-8,11,14H,9-10,12-13H2,1-6H3