ethyl 2-[9-(4-isocyanophenyl)carbonyl-9-azaspiro[5.5]undecan-3-yl]ethanoate

Systemtic Name: ethyl 2-[9-(4-isocyanophenyl)carbonyl-9-azaspiro[5.5]undecan-3-yl]ethanoate Openeye Name: ethyl 2-[9-(4-isocyanobenzoyl)-9-azaspiro[5.5]undecan-3-yl]acetate CAS Name: 2-[9-[(4-isocyanophenyl)-oxomethyl]-9-azaspiro[5.5]undecan-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[9-(4-isocyanobenzoyl)-9-azaspiro[5.5]undecan-3-yl]acetate Traditional Name: 2-[9-(4-isocyanobenzoyl)-9-azaspiro[5.5]undecan-3-yl]acetic acid ethyl ester Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCC2(CC1)CCN(CC2)C(=O)C3=CC=C(C=C3)[N+]#[C-]

Isomeric SMILES

CCOC(=O)CC1CCC2(CC1)CCN(CC2)C(=O)C3=CC=C(C=C3)[N+]#[C-]

InChI

InChI=1S/C22H28N2O3/c1-3-27-20(25)16-17-8-10-22(11-9-17)12-14-24(15-13-22)21(26)18-4-6-19(23-2)7-5-18/h4-7,17H,3,8-16H2,1H3