3-(4-phenylpiperazin-1-yl)propyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 3-(4-phenylpiperazin-1-yl)propyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 3-(4-phenylpiperazin-1-yl)propyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 3-(4-phenyl-1-piperazinyl)propyl ester IUPAC Name: 3-(4-phenylpiperazin-1-yl)propyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 3-(4-phenylpiperazino)propyl ester Formula: C21H26ClN3O3 MolecularWeight: 403.90244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCCN2CCN(CC2)C3=CC=CC=C3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCCN2CCN(CC2)C3=CC=CC=C3)Cl)N

InChI

InChI=1S/C21H26ClN3O3/c1-27-20-15-19(23)18(22)14-17(20)21(26)28-13-5-8-24-9-11-25(12-10-24)16-6-3-2-4-7-16/h2-4,6-7,14-15H,5,8-13,23H2,1H3