4-chloranyl-3-[(3-methyl-4-pyrrolidin-1-yl-phenyl)methylideneamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[(3-methyl-4-pyrrolidin-1-yl-phenyl)methylideneamino]benzoic acid Openeye Name: 4-chloro-3-[(3-methyl-4-pyrrolidin-1-yl-phenyl)methyleneamino]benzoic acid CAS Name: 4-chloro-3-[[3-methyl-4-(1-pyrrolidinyl)phenyl]methylideneamino]benzoic acid IUPAC Name: 4-chloro-3-[(3-methyl-4-pyrrolidin-1-ylphenyl)methylideneamino]benzoic acid Traditional Name: 4-chloro-3-[(3-methyl-4-pyrrolidino-benzylidene)amino]benzoic acid Formula: C19H19ClN2O2 MolecularWeight: 342.81936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=NC2=C(C=CC(=C2)C(=O)O)Cl)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C=NC2=C(C=CC(=C2)C(=O)O)Cl)N3CCCC3

InChI

InChI=1S/C19H19ClN2O2/c1-13-10-14(4-7-18(13)22-8-2-3-9-22)12-21-17-11-15(19(23)24)5-6-16(17)20/h4-7,10-12H,2-3,8-9H2,1H3,(H,23,24)