4-[2-[(4-butoxyphenyl)methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile

Systemtic Name: 4-[2-[(4-butoxyphenyl)methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile Openeye Name: 4-[2-[(4-butoxyphenyl)methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile CAS Name: 4-[2-[(4-butoxyphenyl)methyl]-1-diazinanyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[2-[(4-butoxyphenyl)methyl]diazinan-1-yl]naphthalene-1-carbonitrile Traditional Name: 4-[2-(4-butoxybenzyl)hexahydropyridazin-1-yl]naphthalene-1-carbonitrile Formula: C26H29N3O MolecularWeight: 399.52796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN2CCCCN2C3=CC=C(C4=CC=CC=C43)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN2CCCCN2C3=CC=C(C4=CC=CC=C43)C#N

InChI

InChI=1S/C26H29N3O/c1-2-3-18-30-23-13-10-21(11-14-23)20-28-16-6-7-17-29(28)26-15-12-22(19-27)24-8-4-5-9-25(24)26/h4-5,8-15H,2-3,6-7,16-18,20H2,1H3