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

Systemtic Name: (E)-2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-3-naphthalen-2-yl-prop-2-enenitrile Openeye Name: (E)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-(2-naphthyl)prop-2-enenitrile CAS Name: (E)-2-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-3-(2-naphthalenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-naphthalen-2-ylprop-2-enenitrile Traditional Name: (E)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]-3-(2-naphthyl)acrylonitrile Formula: C25H23N3O2 MolecularWeight: 397.46902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C(=CC3=CC4=CC=CC=C4C=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)/C(=C/C3=CC4=CC=CC=C4C=C3)/C#N

InChI

InChI=1S/C25H23N3O2/c1-30-24-10-8-23(9-11-24)27-12-14-28(15-13-27)25(29)22(18-26)17-19-6-7-20-4-2-3-5-21(20)16-19/h2-11,16-17H,12-15H2,1H3/b22-17+