ethyl 3-[(4-butyl-3-oxidanylidene-2-propan-2-yl-1,4,8-triazaspiro[4.5]decan-8-yl)carbonylamino]benzoate

Systemtic Name: ethyl 3-[(4-butyl-3-oxidanylidene-2-propan-2-yl-1,4,8-triazaspiro[4.5]decan-8-yl)carbonylamino]benzoate Openeye Name: ethyl 3-[(4-butyl-2-isopropyl-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbonyl)amino]benzoate CAS Name: 3-[[(4-butyl-3-oxo-2-propan-2-yl-1,4,8-triazaspiro[4.5]decan-8-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-butyl-3-oxo-2-propan-2-yl-1,4,8-triazaspiro[4.5]decane-8-carbonyl)amino]benzoate Traditional Name: 3-[(4-butyl-2-isopropyl-3-keto-1,4,8-triazaspiro[4.5]decane-8-carbonyl)amino]benzoic acid ethyl ester Formula: C24H36N4O4 MolecularWeight: 444.56704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC12CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OCC)C(C)C

Isomeric SMILES

CCCCN1C(=O)C(NC12CCN(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OCC)C(C)C

InChI

InChI=1S/C24H36N4O4/c1-5-7-13-28-21(29)20(17(3)4)26-24(28)11-14-27(15-12-24)23(31)25-19-10-8-9-18(16-19)22(30)32-6-2/h8-10,16-17,20,26H,5-7,11-15H2,1-4H3,(H,25,31)