pentyl 8-(2-pyrrol-1-ylphenyl)carbonyl-3,8-diazaspiro[4.5]decane-3-carboxylate

Systemtic Name: pentyl 8-(2-pyrrol-1-ylphenyl)carbonyl-3,8-diazaspiro[4.5]decane-3-carboxylate Openeye Name: pentyl 8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decane-3-carboxylate CAS Name: 8-[oxo-[2-(1-pyrrolyl)phenyl]methyl]-3,8-diazaspiro[4.5]decane-3-carboxylic acid pentyl ester IUPAC Name: pentyl 8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decane-3-carboxylate Traditional Name: 8-(2-pyrrol-1-ylbenzoyl)-3,8-diazaspiro[4.5]decane-3-carboxylic acid amyl ester Formula: C25H33N3O3 MolecularWeight: 423.54782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3/c1-2-3-8-19-31-24(30)28-18-13-25(20-28)11-16-27(17-12-25)23(29)21-9-4-5-10-22(21)26-14-6-7-15-26/h4-7,9-10,14-15H,2-3,8,11-13,16-20H2,1H3