3-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-[(4-ethoxyphenyl)methyl]piperazine-1-carbonyl]benzonitrile CAS Name: 3-[[4-[(4-ethoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-[(4-ethoxyphenyl)methyl]piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-(4-ethoxybenzyl)piperazine-1-carbonyl]benzonitrile Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H23N3O2/c1-2-26-20-8-6-17(7-9-20)16-23-10-12-24(13-11-23)21(25)19-5-3-4-18(14-19)15-22/h3-9,14H,2,10-13,16H2,1H3