1-[(4-propan-2-ylphenyl)-pyridin-3-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(4-propan-2-ylphenyl)-pyridin-3-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-isopropylphenyl)-(3-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(4-propan-2-ylphenyl)-(3-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-propan-2-ylphenyl)-pyridin-3-ylmethyl]-1,4-diazepane Traditional Name: 1-[p-cumenyl(3-pyridyl)methyl]-1,4-diazepane Formula: C20H27N3 MolecularWeight: 309.44848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CN=CC=C2)N3CCCNCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CN=CC=C2)N3CCCNCC3

InChI

InChI=1S/C20H27N3/c1-16(2)17-6-8-18(9-7-17)20(19-5-3-10-22-15-19)23-13-4-11-21-12-14-23/h3,5-10,15-16,20-21H,4,11-14H2,1-2H3