5-chloranylpentyl 4-azanyl-3-bromanyl-5-[(cyclohexylamino)methyl]benzoate

Systemtic Name: 5-chloranylpentyl 4-azanyl-3-bromanyl-5-[(cyclohexylamino)methyl]benzoate Openeye Name: 5-chloropentyl 4-amino-3-bromo-5-[(cyclohexylamino)methyl]benzoate CAS Name: 4-amino-3-bromo-5-[(cyclohexylamino)methyl]benzoic acid 5-chloropentyl ester IUPAC Name: 5-chloropentyl 4-amino-3-bromo-5-[(cyclohexylamino)methyl]benzoate Traditional Name: 4-amino-3-bromo-5-[(cyclohexylamino)methyl]benzoic acid 5-chloropentyl ester Formula: C19H28BrClN2O2 MolecularWeight: 431.79482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCC2=C(C(=CC(=C2)C(=O)OCCCCCCl)Br)N

Isomeric SMILES

C1CCC(CC1)NCC2=C(C(=CC(=C2)C(=O)OCCCCCCl)Br)N

InChI

InChI=1S/C19H28BrClN2O2/c20-17-12-14(19(24)25-10-6-2-5-9-21)11-15(18(17)22)13-23-16-7-3-1-4-8-16/h11-12,16,23H,1-10,13,22H2