7-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)methyl]-10-(4-methoxyphenyl)-10-aza-7-azoniaspiro[4.5]decan-9-one

Systemtic Name: 7-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)methyl]-10-(4-methoxyphenyl)-10-aza-7-azoniaspiro[4.5]decan-9-one Openeye Name: 7-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)methyl]-10-(4-methoxyphenyl)-10-aza-7-azoniaspiro[4.5]decan-9-one CAS Name: 7-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)methyl]-10-(4-methoxyphenyl)-10-aza-7-azoniaspiro[4.5]decan-9-one IUPAC Name: 7-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)methyl]-10-(4-methoxyphenyl)-10-aza-7-azoniaspiro[4.5]decan-9-one Traditional Name: 7-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)methyl]-10-(4-methoxyphenyl)-10-aza-7-azoniaspiro[4.5]decan-9-one Formula: C27H33N4O3+ MolecularWeight: 461.57592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C[NH+]3CC(=O)N(C4(C3)CCCC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C[NH+]3CC(=O)N(C4(C3)CCCC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H32N4O3/c1-20-24(26(33)31(28(20)2)22-9-5-4-6-10-22)17-29-18-25(32)30(27(19-29)15-7-8-16-27)21-11-13-23(34-3)14-12-21/h4-6,9-14H,7-8,15-19H2,1-3H3/p+1