4-bromanyl-N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-N-(3-chloranyl-4-pyrrolidin-1-yl-phenyl)-3-methoxy-naphthalene-2-carboxamide Openeye Name: 4-bromo-N-(3-chloro-4-pyrrolidin-1-yl-phenyl)-3-methoxy-naphthalene-2-carboxamide CAS Name: 4-bromo-N-[3-chloro-4-(1-pyrrolidinyl)phenyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: 4-bromo-N-(3-chloro-4-pyrrolidin-1-ylphenyl)-3-methoxynaphthalene-2-carboxamide Traditional Name: 4-bromo-N-(3-chloro-4-pyrrolidino-phenyl)-3-methoxy-2-naphthamide Formula: C22H20BrClN2O2 MolecularWeight: 459.7634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1C(=O)NC3=CC(=C(C=C3)N4CCCC4)Cl)Br

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1C(=O)NC3=CC(=C(C=C3)N4CCCC4)Cl)Br

InChI

InChI=1S/C22H20BrClN2O2/c1-28-21-17(12-14-6-2-3-7-16(14)20(21)23)22(27)25-15-8-9-19(18(24)13-15)26-10-4-5-11-26/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H,25,27)