[3-[(E)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]indol-1-yl]methyl-bis(2-methylpropyl)azanium

Systemtic Name: [3-[(E)-(3-methylidene-5-oxidanylidene-1-phenyl-pyrazolidin-4-ylidene)methyl]indol-1-yl]methyl-bis(2-methylpropyl)azanium Openeye Name: diisobutyl-[[3-[(E)-(3-methylene-5-oxo-1-phenyl-pyrazolidin-4-ylidene)methyl]indol-1-yl]methyl]ammonium CAS Name: [3-[(E)-(3-methylene-5-oxo-1-phenyl-4-pyrazolidinylidene)methyl]-1-indolyl]methyl-bis(2-methylpropyl)ammonium IUPAC Name: [3-[(E)-(3-methylidene-5-oxo-1-phenylpyrazolidin-4-ylidene)methyl]indol-1-yl]methyl-bis(2-methylpropyl)azanium Traditional Name: diisobutyl-[[3-[(E)-(5-keto-3-methylene-1-phenyl-pyrazolidin-4-ylidene)methyl]indol-1-yl]methyl]ammonium Formula: C28H35N4O+ MolecularWeight: 443.6037

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CC(C)C)CN1C=C(C2=CC=CC=C21)C=C3C(=C)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)C[NH+](CC(C)C)CN1C=C(C2=CC=CC=C21)/C=C/3\C(=C)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C28H34N4O/c1-20(2)16-30(17-21(3)4)19-31-18-23(25-13-9-10-14-27(25)31)15-26-22(5)29-32(28(26)33)24-11-7-6-8-12-24/h6-15,18,20-21,29H,5,16-17,19H2,1-4H3/p+1/b26-15+