N-methyl-7-(2,4,4-trimethylpentan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: N-methyl-7-(2,4,4-trimethylpentan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: N-methyl-7-(1,1,3,3-tetramethylbutyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: N-methyl-7-(2,4,4-trimethylpentan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: N-methyl-7-(2,4,4-trimethylpentan-2-yl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: methyl-[7-(1,1,3,3-tetramethylbutyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]amine Formula: C19H31NO MolecularWeight: 289.45554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC2=C(C=C1)OCCCC2NC

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC2=C(C=C1)OCCCC2NC

InChI

InChI=1S/C19H31NO/c1-18(2,3)13-19(4,5)14-9-10-17-15(12-14)16(20-6)8-7-11-21-17/h9-10,12,16,20H,7-8,11,13H2,1-6H3