(4Z)-5-(methoxymethyl)-2-phenyl-4-[(4-pyrrolidin-1-ylphenyl)methylidene]pyrazol-3-one

Systemtic Name: (4Z)-5-(methoxymethyl)-2-phenyl-4-[(4-pyrrolidin-1-ylphenyl)methylidene]pyrazol-3-one Openeye Name: (4Z)-5-(methoxymethyl)-2-phenyl-4-[(4-pyrrolidin-1-ylphenyl)methylene]pyrazol-3-one CAS Name: (4Z)-5-(methoxymethyl)-2-phenyl-4-[[4-(1-pyrrolidinyl)phenyl]methylidene]-3-pyrazolone IUPAC Name: (4Z)-5-(methoxymethyl)-2-phenyl-4-[(4-pyrrolidin-1-ylphenyl)methylidene]pyrazol-3-one Traditional Name: (4Z)-5-(methoxymethyl)-2-phenyl-4-(4-pyrrolidinobenzylidene)-2-pyrazolin-3-one Formula: C22H23N3O2 MolecularWeight: 361.43692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN(C(=O)C1=CC2=CC=C(C=C2)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

COCC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2/c1-27-16-21-20(22(26)25(23-21)19-7-3-2-4-8-19)15-17-9-11-18(12-10-17)24-13-5-6-14-24/h2-4,7-12,15H,5-6,13-14,16H2,1H3/b20-15-