methyl 4-[N-(3-chlorophenyl)-C-(4-propylpiperazin-1-yl)carbonimidoyl]benzoate

Systemtic Name: methyl 4-[N-(3-chlorophenyl)-C-(4-propylpiperazin-1-yl)carbonimidoyl]benzoate Openeye Name: methyl 4-[N-(3-chlorophenyl)-C-(4-propylpiperazin-1-yl)carbonimidoyl]benzoate CAS Name: 4-[(3-chlorophenyl)imino-(4-propyl-1-piperazinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[N-(3-chlorophenyl)-C-(4-propylpiperazin-1-yl)carbonimidoyl]benzoate Traditional Name: 4-[N-(3-chlorophenyl)-C-(4-propylpiperazino)carbonimidoyl]benzoic acid methyl ester Formula: C22H26ClN3O2 MolecularWeight: 399.91374

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=NC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCN1CCN(CC1)C(=NC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H26ClN3O2/c1-3-11-25-12-14-26(15-13-25)21(24-20-6-4-5-19(23)16-20)17-7-9-18(10-8-17)22(27)28-2/h4-10,16H,3,11-15H2,1-2H3