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

Systemtic Name: tert-butyl 4-[methyl-[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-yl]carbonyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[methyl-[7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[methyl-[[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[methyl-[7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[methyl-[7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carbonyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H36N2O4 MolecularWeight: 476.60714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)N(C)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)N(C)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H36N2O4/c1-20-6-8-21(9-7-20)22-10-11-26-24(18-22)19-23(14-17-34-26)27(32)30(5)25-12-15-31(16-13-25)28(33)35-29(2,3)4/h6-11,18-19,25H,12-17H2,1-5H3