2-(3-azanyl-2-oxidanyl-propyl)-4-(4-fluorophenyl)-8-[(8-methylnaphthalen-1-yl)methyl]-2,4,8-triazaspiro[4.5]decan-1-one; sulfuric acid

Systemtic Name: 2-(3-azanyl-2-oxidanyl-propyl)-4-(4-fluorophenyl)-8-[(8-methylnaphthalen-1-yl)methyl]-2,4,8-triazaspiro[4.5]decan-1-one; sulfuric acid Openeye Name: 2-(3-amino-2-hydroxy-propyl)-4-(4-fluorophenyl)-8-[(8-methyl-1-naphthyl)methyl]-2,4,8-triazaspiro[4.5]decan-1-one; sulfuric acid CAS Name: 2-(3-amino-2-hydroxypropyl)-4-(4-fluorophenyl)-8-[(8-methyl-1-naphthalenyl)methyl]-2,4,8-triazaspiro[4.5]decan-1-one; sulfuric acid IUPAC Name: 2-(3-amino-2-hydroxypropyl)-4-(4-fluorophenyl)-8-[(8-methylnaphthalen-1-yl)methyl]-2,4,8-triazaspiro[4.5]decan-1-one; sulfuric acid Traditional Name: 2-(3-amino-2-hydroxy-propyl)-4-(4-fluorophenyl)-8-[(8-methyl-1-naphthyl)methyl]-2,4,8-triazaspiro[4.5]decan-1-one; sulfuric acid Formula: C28H35FN4O6S MolecularWeight: 574.664103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(=CC=C2)CN3CCC4(CC3)C(=O)N(CN4C5=CC=C(C=C5)F)CC(CN)O.OS(=O)(=O)O

Isomeric SMILES

CC1=CC=CC2=C1C(=CC=C2)CN3CCC4(CC3)C(=O)N(CN4C5=CC=C(C=C5)F)CC(CN)O.OS(=O)(=O)O

InChI

InChI=1S/C28H33FN4O2.H2O4S/c1-20-4-2-5-21-6-3-7-22(26(20)21)17-31-14-12-28(13-15-31)27(35)32(18-25(34)16-30)19-33(28)24-10-8-23(29)9-11-24;1-5(2,3)4/h2-11,25,34H,12-19,30H2,1H3;(H2,1,2,3,4)