tert-butyl 3-oxidanylidene-3-[8-(2-pyrrol-1-ylphenyl)carbonyl-3,8-diazaspiro[4.5]decan-3-yl]propanoate

Systemtic Name: tert-butyl 3-oxidanylidene-3-[8-(2-pyrrol-1-ylphenyl)carbonyl-3,8-diazaspiro[4.5]decan-3-yl]propanoate Openeye Name: tert-butyl 3-oxo-3-[8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decan-3-yl]propanoate CAS Name: 3-oxo-3-[8-[oxo-[2-(1-pyrrolyl)phenyl]methyl]-3,8-diazaspiro[4.5]decan-3-yl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxo-3-[8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decan-3-yl]propanoate Traditional Name: 3-keto-3-[8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decan-3-yl]propionic acid tert-butyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(=O)N1CCC2(C1)CCN(CC2)C(=O)C3=CC=CC=C3N4C=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)CC(=O)N1CCC2(C1)CCN(CC2)C(=O)C3=CC=CC=C3N4C=CC=C4

InChI

InChI=1S/C26H33N3O4/c1-25(2,3)33-23(31)18-22(30)29-17-12-26(19-29)10-15-28(16-11-26)24(32)20-8-4-5-9-21(20)27-13-6-7-14-27/h4-9,13-14H,10-12,15-19H2,1-3H3