(Z)-3-[1-(phenylmethyl)indol-3-yl]-2-(4-phenylpiperazin-1-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-[1-(phenylmethyl)indol-3-yl]-2-(4-phenylpiperazin-1-yl)carbonyl-prop-2-enenitrile Openeye Name: (Z)-3-(1-benzylindol-3-yl)-2-(4-phenylpiperazine-1-carbonyl)prop-2-enenitrile CAS Name: (Z)-2-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-[1-(phenylmethyl)-3-indolyl]-2-propenenitrile IUPAC Name: (Z)-3-(1-benzylindol-3-yl)-2-(4-phenylpiperazine-1-carbonyl)prop-2-enenitrile Traditional Name: (Z)-3-(1-benzylindol-3-yl)-2-(4-phenylpiperazine-1-carbonyl)acrylonitrile Formula: C29H26N4O MolecularWeight: 446.54294

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)/C(=C\C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5)/C#N

InChI

InChI=1S/C29H26N4O/c30-20-24(29(34)32-17-15-31(16-18-32)26-11-5-2-6-12-26)19-25-22-33(21-23-9-3-1-4-10-23)28-14-8-7-13-27(25)28/h1-14,19,22H,15-18,21H2/b24-19-