N-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]-3-chloranyl-4-pyrrolidin-1-yl-aniline

Systemtic Name: N-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]-3-chloranyl-4-pyrrolidin-1-yl-aniline Openeye Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]-3-chloro-4-pyrrolidin-1-yl-aniline CAS Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-3-chloro-4-(1-pyrrolidinyl)aniline IUPAC Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]-3-chloro-4-pyrrolidin-1-ylaniline Traditional Name: [3-bromo-4-(4-fluorobenzyl)oxy-5-methoxy-benzyl]-(3-chloro-4-pyrrolidino-phenyl)amine Formula: C25H25BrClFN2O2 MolecularWeight: 519.833603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=CC(=C(C=C2)N3CCCC3)Cl)Br)OCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=CC(=C(C=C2)N3CCCC3)Cl)Br)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H25BrClFN2O2/c1-31-24-13-18(12-21(26)25(24)32-16-17-4-6-19(28)7-5-17)15-29-20-8-9-23(22(27)14-20)30-10-2-3-11-30/h4-9,12-14,29H,2-3,10-11,15-16H2,1H3