tert-butyl N-[5-methyl-2-oxidanylidene-1-(7-oxidanyl-1,3,4,5-tetrahydro-2-benzazepin-2-yl)hexan-3-yl]carbamate

Systemtic Name: tert-butyl N-[5-methyl-2-oxidanylidene-1-(7-oxidanyl-1,3,4,5-tetrahydro-2-benzazepin-2-yl)hexan-3-yl]carbamate Openeye Name: tert-butyl N-[1-[2-(7-hydroxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl)acetyl]-3-methyl-butyl]carbamate CAS Name: N-[1-(7-hydroxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl)-5-methyl-2-oxohexan-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(7-hydroxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl)-5-methyl-2-oxohexan-3-yl]carbamate Traditional Name: N-[1-[2-(7-hydroxy-1,3,4,5-tetrahydro-2-benzazepin-2-yl)acetyl]-3-methyl-butyl]carbamic acid tert-butyl ester Formula: C22H34N2O4 MolecularWeight: 390.51636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)CN1CCCC2=C(C1)C=CC(=C2)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC(C(=O)CN1CCCC2=C(C1)C=CC(=C2)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H34N2O4/c1-15(2)11-19(23-21(27)28-22(3,4)5)20(26)14-24-10-6-7-16-12-18(25)9-8-17(16)13-24/h8-9,12,15,19,25H,6-7,10-11,13-14H2,1-5H3,(H,23,27)