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

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-3-naphthalen-1-yl-prop-2-enenitrile Openeye Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-3-(1-naphthyl)prop-2-enenitrile CAS Name: 2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-3-(1-naphthalenyl)-2-propenenitrile IUPAC Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-3-naphthalen-1-ylprop-2-enenitrile Traditional Name: 2-(4-benzhydrylpiperazine-1-carbonyl)-3-(1-naphthyl)acrylonitrile Formula: C31H27N3O MolecularWeight: 457.56558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C(=CC4=CC=CC5=CC=CC=C54)C#N

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C(=CC4=CC=CC5=CC=CC=C54)C#N

InChI

InChI=1S/C31H27N3O/c32-23-28(22-27-16-9-15-24-10-7-8-17-29(24)27)31(35)34-20-18-33(19-21-34)30(25-11-3-1-4-12-25)26-13-5-2-6-14-26/h1-17,22,30H,18-21H2