2-piperazin-1-ylethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-piperazin-1-ylethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-piperazin-1-ylethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-(1-piperazinyl)ethyl ester IUPAC Name: 2-piperazin-1-ylethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-piperazinoethyl ester Formula: C14H20ClN3O3 MolecularWeight: 313.7799

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCNCC2)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCNCC2)Cl)N

InChI

InChI=1S/C14H20ClN3O3/c1-20-13-9-12(16)11(15)8-10(13)14(19)21-7-6-18-4-2-17-3-5-18/h8-9,17H,2-7,16H2,1H3