(9S)-11-butyl-9-(2-methylpropyl)-3-[(4-morpholin-4-ylcarbonylphenyl)methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride

Systemtic Name: (9S)-11-butyl-9-(2-methylpropyl)-3-[(4-morpholin-4-ylcarbonylphenyl)methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride Openeye Name: (9S)-11-butyl-9-isobutyl-3-[[4-(morpholine-4-carbonyl)phenyl]methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride CAS Name: (9S)-11-butyl-9-(2-methylpropyl)-3-[[4-[4-morpholinyl(oxo)methyl]phenyl]methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride IUPAC Name: (9S)-11-butyl-9-(2-methylpropyl)-3-[[4-(morpholine-4-carbonyl)phenyl]methyl]-3,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride Traditional Name: (9S)-11-butyl-9-isobutyl-3-[4-(morpholine-4-carbonyl)benzyl]-3,8,11-triazaspiro[5.5]undecane-7,10-quinone hydrochloride Formula: C28H43ClN4O4 MolecularWeight: 535.11842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)C(=O)N4CCOCC4)CC(C)C.Cl

Isomeric SMILES

CCCCN1C(=O)[C@@H](NC(=O)C12CCN(CC2)CC3=CC=C(C=C3)C(=O)N4CCOCC4)CC(C)C.Cl

InChI

InChI=1S/C28H42N4O4.ClH/c1-4-5-12-32-26(34)24(19-21(2)3)29-27(35)28(32)10-13-30(14-11-28)20-22-6-8-23(9-7-22)25(33)31-15-17-36-18-16-31;/h6-9,21,24H,4-5,10-20H2,1-3H3,(H,29,35);1H/t24-;/m0./s1