tert-butyl 4-[[3-(cyclopropylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-(cyclopropylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(cyclopropylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[3-(cyclopropylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(cyclopropylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[3-(cyclopropylmethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]oxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H38N2O3 MolecularWeight: 414.58082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC2=CC3=C(CCN(CC3)CC4CC4)C=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC2=CC3=C(CCN(CC3)CC4CC4)C=C2

InChI

InChI=1S/C25H38N2O3/c1-25(2,3)30-24(28)27-14-8-20(9-15-27)18-29-23-7-6-21-10-12-26(17-19-4-5-19)13-11-22(21)16-23/h6-7,16,19-20H,4-5,8-15,17-18H2,1-3H3