ethyl 4-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]piperidine-1-carboxylate CAS Name: 4-[[3-(3-bromo-4-methoxyphenyl)-1-oxopropyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(3-bromo-4-methoxyphenyl)propanoylamino]piperidine-1-carboxylate Traditional Name: 4-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C18H25BrN2O4 MolecularWeight: 413.3061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C18H25BrN2O4/c1-3-25-18(23)21-10-8-14(9-11-21)20-17(22)7-5-13-4-6-16(24-2)15(19)12-13/h4,6,12,14H,3,5,7-11H2,1-2H3,(H,20,22)