N-(3-imidazol-1-ylpropyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: N-[3-(1-imidazolyl)propyl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: N-(3-imidazol-1-ylpropyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: 3-imidazol-1-ylpropyl-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amine Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OCCCC2NCCCN3C=CN=C3

Isomeric SMILES

CC1=CC=CC2=C1OCCCC2NCCCN3C=CN=C3

InChI

InChI=1S/C17H23N3O/c1-14-5-2-6-15-16(7-3-12-21-17(14)15)19-8-4-10-20-11-9-18-13-20/h2,5-6,9,11,13,16,19H,3-4,7-8,10,12H2,1H3