methyl 3-methoxy-2-[phenylcarbonyl-[2-(4-phenylpiperazin-1-yl)ethyl]amino]benzoate

Systemtic Name: methyl 3-methoxy-2-[phenylcarbonyl-[2-(4-phenylpiperazin-1-yl)ethyl]amino]benzoate Openeye Name: methyl 2-[benzoyl-[2-(4-phenylpiperazin-1-yl)ethyl]amino]-3-methoxy-benzoate CAS Name: 2-[benzoyl-[2-(4-phenyl-1-piperazinyl)ethyl]amino]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 2-[benzoyl-[2-(4-phenylpiperazin-1-yl)ethyl]amino]-3-methoxybenzoate Traditional Name: 2-[benzoyl-[2-(4-phenylpiperazino)ethyl]amino]-3-methoxy-benzoic acid methyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1N(CCN2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1N(CCN2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C28H31N3O4/c1-34-25-15-9-14-24(28(33)35-2)26(25)31(27(32)22-10-5-3-6-11-22)21-18-29-16-19-30(20-17-29)23-12-7-4-8-13-23/h3-15H,16-21H2,1-2H3