ethyl 3-[9-(4-cyanophenyl)carbonyl-9-azaspiro[5.5]undecan-3-yl]propanoate

Systemtic Name: ethyl 3-[9-(4-cyanophenyl)carbonyl-9-azaspiro[5.5]undecan-3-yl]propanoate Openeye Name: ethyl 3-[9-(4-cyanobenzoyl)-9-azaspiro[5.5]undecan-3-yl]propanoate CAS Name: 3-[9-[(4-cyanophenyl)-oxomethyl]-9-azaspiro[5.5]undecan-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[9-(4-cyanobenzoyl)-9-azaspiro[5.5]undecan-3-yl]propanoate Traditional Name: 3-[9-(4-cyanobenzoyl)-9-azaspiro[5.5]undecan-3-yl]propionic acid ethyl ester Formula: C23H30N2O3 MolecularWeight: 382.4959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1CCC2(CC1)CCN(CC2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)CCC1CCC2(CC1)CCN(CC2)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H30N2O3/c1-2-28-21(26)8-5-18-9-11-23(12-10-18)13-15-25(16-14-23)22(27)20-6-3-19(17-24)4-7-20/h3-4,6-7,18H,2,5,8-16H2,1H3