2-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile

Systemtic Name: 2-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Openeye Name: 4-(4-benzylpiperazin-1-yl)-2-oxo-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile CAS Name: 2-oxo-4-[4-(phenylmethyl)-1-piperazinyl]-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile IUPAC Name: 4-(4-benzylpiperazin-1-yl)-2-oxo-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Traditional Name: 4-(4-benzylpiperazino)-2-keto-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2(CC1)C(C(=O)NC(=N2)N3CCN(CC3)CC4=CC=CC=C4)C#N

Isomeric SMILES

C1CCCC2(CC1)C(C(=O)NC(=N2)N3CCN(CC3)CC4=CC=CC=C4)C#N

InChI

InChI=1S/C22H29N5O/c23-16-19-20(28)24-21(25-22(19)10-6-1-2-7-11-22)27-14-12-26(13-15-27)17-18-8-4-3-5-9-18/h3-5,8-9,19H,1-2,6-7,10-15,17H2,(H,24,25,28)