tert-butyl 4-[ethyl-[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-yl]carbonyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[ethyl-[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-yl]carbonyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[ethyl-[7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[ethyl-[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[ethyl-[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[ethyl-[7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carbonyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H38N2O4 MolecularWeight: 490.63372

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)C(=O)OC(C)(C)C)C(=O)C2=CC3=C(C=CC(=C3)C4=CC=C(C=C4)C)OCC2

Isomeric SMILES

CCN(C1CCN(CC1)C(=O)OC(C)(C)C)C(=O)C2=CC3=C(C=CC(=C3)C4=CC=C(C=C4)C)OCC2

InChI

InChI=1S/C30H38N2O4/c1-6-32(26-13-16-31(17-14-26)29(34)36-30(3,4)5)28(33)24-15-18-35-27-12-11-23(19-25(27)20-24)22-9-7-21(2)8-10-22/h7-12,19-20,26H,6,13-18H2,1-5H3