6-methoxy-3-[4-(phenylmethyl)piperazin-1-yl]quinoxaline-2-carbonitrile

Systemtic Name: 6-methoxy-3-[4-(phenylmethyl)piperazin-1-yl]quinoxaline-2-carbonitrile Openeye Name: 3-(4-benzylpiperazin-1-yl)-6-methoxy-quinoxaline-2-carbonitrile CAS Name: 6-methoxy-3-[4-(phenylmethyl)-1-piperazinyl]-2-quinoxalinecarbonitrile IUPAC Name: 3-(4-benzylpiperazin-1-yl)-6-methoxyquinoxaline-2-carbonitrile Traditional Name: 3-(4-benzylpiperazino)-6-methoxy-quinoxaline-2-carbonitrile Formula: C21H21N5O MolecularWeight: 359.42434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(N=C2C=C1)C#N)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=NC(=C(N=C2C=C1)C#N)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H21N5O/c1-27-17-7-8-18-19(13-17)24-21(20(14-22)23-18)26-11-9-25(10-12-26)15-16-5-3-2-4-6-16/h2-8,13H,9-12,15H2,1H3