ethyl 5-[2-(4-isocyanophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]pentanoate

Systemtic Name: ethyl 5-[2-(4-isocyanophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]pentanoate Openeye Name: ethyl 5-[2-(4-isocyanophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]pentanoate CAS Name: 5-[2-(4-isocyanophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-isocyanophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]pentanoate Traditional Name: 5-[2-(4-isocyanophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]valeric acid ethyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1CCC2(CC1)CC(=NO2)C3=CC=C(C=C3)[N+]#[C-]

Isomeric SMILES

CCOC(=O)CCCCN1CCC2(CC1)CC(=NO2)C3=CC=C(C=C3)[N+]#[C-]

InChI

InChI=1S/C21H27N3O3/c1-3-26-20(25)6-4-5-13-24-14-11-21(12-15-24)16-19(23-27-21)17-7-9-18(22-2)10-8-17/h7-10H,3-6,11-16H2,1H3