1-[(3-methylpyridin-2-yl)-phenyl-methyl]-1,4-diazepane

Systemtic Name: 1-[(3-methylpyridin-2-yl)-phenyl-methyl]-1,4-diazepane Openeye Name: 1-[(3-methyl-2-pyridyl)-phenyl-methyl]-1,4-diazepane CAS Name: 1-[(3-methyl-2-pyridinyl)-phenylmethyl]-1,4-diazepane IUPAC Name: 1-[(3-methylpyridin-2-yl)-phenylmethyl]-1,4-diazepane Traditional Name: 1-[(3-methyl-2-pyridyl)-phenyl-methyl]-1,4-diazepane Formula: C18H23N3 MolecularWeight: 281.39532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=CC=CC=C2)N3CCCNCC3

Isomeric SMILES

CC1=C(N=CC=C1)C(C2=CC=CC=C2)N3CCCNCC3

InChI

InChI=1S/C18H23N3/c1-15-7-5-11-20-17(15)18(16-8-3-2-4-9-16)21-13-6-10-19-12-14-21/h2-5,7-9,11,18-19H,6,10,12-14H2,1H3