2-chloroethyl 4-azanyl-3-bromanyl-5-(pyrrolidin-1-ylmethyl)benzoate

Systemtic Name: 2-chloroethyl 4-azanyl-3-bromanyl-5-(pyrrolidin-1-ylmethyl)benzoate Openeye Name: 2-chloroethyl 4-amino-3-bromo-5-(pyrrolidin-1-ylmethyl)benzoate CAS Name: 4-amino-3-bromo-5-(1-pyrrolidinylmethyl)benzoic acid 2-chloroethyl ester IUPAC Name: 2-chloroethyl 4-amino-3-bromo-5-(pyrrolidin-1-ylmethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(pyrrolidinomethyl)benzoic acid 2-chloroethyl ester Formula: C14H18BrClN2O2 MolecularWeight: 361.66192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=C(C(=CC(=C2)C(=O)OCCCl)Br)N

Isomeric SMILES

C1CCN(C1)CC2=C(C(=CC(=C2)C(=O)OCCCl)Br)N

InChI

InChI=1S/C14H18BrClN2O2/c15-12-8-10(14(19)20-6-3-16)7-11(13(12)17)9-18-4-1-2-5-18/h7-8H,1-6,9,17H2