phenyl 4-[(4-cyanophenyl)methyl]-4,9-diazaspiro[5.5]undecane-9-carboxylate

Systemtic Name: phenyl 4-[(4-cyanophenyl)methyl]-4,9-diazaspiro[5.5]undecane-9-carboxylate Openeye Name: phenyl 4-[(4-cyanophenyl)methyl]-4,9-diazaspiro[5.5]undecane-9-carboxylate CAS Name: 4-[(4-cyanophenyl)methyl]-4,9-diazaspiro[5.5]undecane-9-carboxylic acid phenyl ester IUPAC Name: phenyl 4-[(4-cyanophenyl)methyl]-4,9-diazaspiro[5.5]undecane-9-carboxylate Traditional Name: 4-(4-cyanobenzyl)-4,9-diazaspiro[5.5]undecane-9-carboxylic acid phenyl ester Formula: C24H27N3O2 MolecularWeight: 389.49008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCN(CC2)C(=O)OC3=CC=CC=C3)CN(C1)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC2(CCN(CC2)C(=O)OC3=CC=CC=C3)CN(C1)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H27N3O2/c25-17-20-7-9-21(10-8-20)18-26-14-4-11-24(19-26)12-15-27(16-13-24)23(28)29-22-5-2-1-3-6-22/h1-3,5-10H,4,11-16,18-19H2