ethyl 3-[(4-methoxyphenyl)carbonylamino]-4-[4-(phenylmethyl)piperazin-1-yl]benzoate

Systemtic Name: ethyl 3-[(4-methoxyphenyl)carbonylamino]-4-[4-(phenylmethyl)piperazin-1-yl]benzoate Openeye Name: ethyl 4-(4-benzylpiperazin-1-yl)-3-[(4-methoxybenzoyl)amino]benzoate CAS Name: 3-[[(4-methoxyphenyl)-oxomethyl]amino]-4-[4-(phenylmethyl)-1-piperazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-benzylpiperazin-1-yl)-3-[(4-methoxybenzoyl)amino]benzoate Traditional Name: 4-(4-benzylpiperazino)-3-(p-anisoylamino)benzoic acid ethyl ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H31N3O4/c1-3-35-28(33)23-11-14-26(25(19-23)29-27(32)22-9-12-24(34-2)13-10-22)31-17-15-30(16-18-31)20-21-7-5-4-6-8-21/h4-14,19H,3,15-18,20H2,1-2H3,(H,29,32)