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

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Openeye Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxo-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile CAS Name: 4-[4-(3-methoxyphenyl)-1-piperazinyl]-2-oxo-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile IUPAC Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxo-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Traditional Name: 2-keto-4-[4-(3-methoxyphenyl)piperazino]-3,5-diazaspiro[5.6]dodec-4-ene-1-carbonitrile Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC4(CCCCCC4)C(C(=O)N3)C#N

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC4(CCCCCC4)C(C(=O)N3)C#N

InChI

InChI=1S/C22H29N5O2/c1-29-18-8-6-7-17(15-18)26-11-13-27(14-12-26)21-24-20(28)19(16-23)22(25-21)9-4-2-3-5-10-22/h6-8,15,19H,2-5,9-14H2,1H3,(H,24,25,28)