tert-butyl 4-[(4-aminocarbonyl-3-methoxy-phenyl)amino]azepane-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-aminocarbonyl-3-methoxy-phenyl)amino]azepane-1-carboxylate Openeye Name: tert-butyl 4-(4-carbamoyl-3-methoxy-anilino)azepane-1-carboxylate CAS Name: 4-(4-carbamoyl-3-methoxyanilino)-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-carbamoyl-3-methoxyanilino)azepane-1-carboxylate Traditional Name: 4-(4-carbamoyl-3-methoxy-anilino)azepane-1-carboxylic acid tert-butyl ester Formula: C19H29N3O4 MolecularWeight: 363.45126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(CC1)NC2=CC(=C(C=C2)C(=O)N)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(CC1)NC2=CC(=C(C=C2)C(=O)N)OC

InChI

InChI=1S/C19H29N3O4/c1-19(2,3)26-18(24)22-10-5-6-13(9-11-22)21-14-7-8-15(17(20)23)16(12-14)25-4/h7-8,12-13,21H,5-6,9-11H2,1-4H3,(H2,20,23)