tert-butyl 4-[[4-(azepan-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-(azepan-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-(azepan-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[4-(1-azepanyl)anilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-(azepan-1-yl)phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[4-(azepan-1-yl)phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H35N3O3 MolecularWeight: 401.5423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C23H35N3O3/c1-23(2,3)29-22(28)26-16-12-18(13-17-26)21(27)24-19-8-10-20(11-9-19)25-14-6-4-5-7-15-25/h8-11,18H,4-7,12-17H2,1-3H3,(H,24,27)