3-bromanyl-4-ethoxy-5-methoxy-N-[(1-phenylpyrrolidin-3-yl)methyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-5-methoxy-N-[(1-phenylpyrrolidin-3-yl)methyl]benzamide Openeye Name: 3-bromo-4-ethoxy-5-methoxy-N-[(1-phenylpyrrolidin-3-yl)methyl]benzamide CAS Name: 3-bromo-4-ethoxy-5-methoxy-N-[(1-phenyl-3-pyrrolidinyl)methyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-5-methoxy-N-[(1-phenylpyrrolidin-3-yl)methyl]benzamide Traditional Name: 3-bromo-4-ethoxy-5-methoxy-N-[(1-phenylpyrrolidin-3-yl)methyl]benzamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NCC2CCN(C2)C3=CC=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NCC2CCN(C2)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H25BrN2O3/c1-3-27-20-18(22)11-16(12-19(20)26-2)21(25)23-13-15-9-10-24(14-15)17-7-5-4-6-8-17/h4-8,11-12,15H,3,9-10,13-14H2,1-2H3,(H,23,25)