4-(3-methanoyl-2-piperazin-1-yl-indol-1-yl)benzenecarbonitrile

Systemtic Name: 4-(3-methanoyl-2-piperazin-1-yl-indol-1-yl)benzenecarbonitrile Openeye Name: 4-(3-formyl-2-piperazin-1-yl-indol-1-yl)benzonitrile CAS Name: 4-[3-formyl-2-(1-piperazinyl)-1-indolyl]benzonitrile IUPAC Name: 4-(3-formyl-2-piperazin-1-ylindol-1-yl)benzonitrile Traditional Name: 4-(3-formyl-2-piperazino-indol-1-yl)benzonitrile Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C3=CC=CC=C3N2C4=CC=C(C=C4)C#N)C=O

Isomeric SMILES

C1CN(CCN1)C2=C(C3=CC=CC=C3N2C4=CC=C(C=C4)C#N)C=O

InChI

InChI=1S/C20H18N4O/c21-13-15-5-7-16(8-6-15)24-19-4-2-1-3-17(19)18(14-25)20(24)23-11-9-22-10-12-23/h1-8,14,22H,9-12H2