9-methyl-N-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: 9-methyl-N-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: 9-methyl-N-(3-pyridylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: 9-methyl-N-(3-pyridinylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: 9-methyl-N-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-(3-pyridylmethyl)amine Formula: C17H20N2O MolecularWeight: 268.3535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OCCCC2NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=CC2=C1OCCCC2NCC3=CN=CC=C3

InChI

InChI=1S/C17H20N2O/c1-13-5-2-7-15-16(8-4-10-20-17(13)15)19-12-14-6-3-9-18-11-14/h2-3,5-7,9,11,16,19H,4,8,10,12H2,1H3