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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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