(E)-2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-3-(3-methylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-3-(3-methylphenyl)prop-2-enenitrile Openeye Name: (E)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-(m-tolyl)prop-2-enenitrile CAS Name: (E)-2-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-3-(3-methylphenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-(3-methylphenyl)prop-2-enenitrile Traditional Name: (E)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-(m-tolyl)acrylonitrile Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=C(C#N)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC(=C1)/C=C(\C#N)/C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H23N3O2/c1-17-4-3-5-18(14-17)15-19(16-23)22(26)25-12-10-24(11-13-25)20-6-8-21(27-2)9-7-20/h3-9,14-15H,10-13H2,1-2H3/b19-15+