(7R)-3-methyl-8-oxidanylidene-10-(4-phenylpiperazin-1-yl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile

Systemtic Name: (7R)-3-methyl-8-oxidanylidene-10-(4-phenylpiperazin-1-yl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile Openeye Name: (7R)-3-methyl-8-oxo-10-(4-phenylpiperazin-1-yl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile CAS Name: (7R)-3-methyl-8-oxo-10-(4-phenyl-1-piperazinyl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile IUPAC Name: (7R)-3-methyl-8-oxo-10-(4-phenylpiperazin-1-yl)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile Traditional Name: (7R)-8-keto-3-methyl-10-(4-phenylpiperazino)-9,11-diazaspiro[5.5]undec-10-ene-7-carbonitrile Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2(CC1)C(C(=O)NC(=N2)N3CCN(CC3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1CCC2(CC1)[C@@H](C(=O)NC(=N2)N3CCN(CC3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C21H27N5O/c1-16-7-9-21(10-8-16)18(15-22)19(27)23-20(24-21)26-13-11-25(12-14-26)17-5-3-2-4-6-17/h2-6,16,18H,7-14H2,1H3,(H,23,24,27)/t16?,18-,21?/m1/s1