ethyl 3-[(4-ethoxyphenyl)carbamoylamino]-4-[4-(3-methoxyphenyl)piperazin-1-yl]benzoate

Systemtic Name: ethyl 3-[(4-ethoxyphenyl)carbamoylamino]-4-[4-(3-methoxyphenyl)piperazin-1-yl]benzoate Openeye Name: ethyl 3-[(4-ethoxyphenyl)carbamoylamino]-4-[4-(3-methoxyphenyl)piperazin-1-yl]benzoate CAS Name: 3-[[(4-ethoxyanilino)-oxomethyl]amino]-4-[4-(3-methoxyphenyl)-1-piperazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-ethoxyphenyl)carbamoylamino]-4-[4-(3-methoxyphenyl)piperazin-1-yl]benzoate Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]-3-(p-phenetylcarbamoylamino)benzoic acid ethyl ester Formula: C29H34N4O5 MolecularWeight: 518.60406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C29H34N4O5/c1-4-37-24-12-10-22(11-13-24)30-29(35)31-26-19-21(28(34)38-5-2)9-14-27(26)33-17-15-32(16-18-33)23-7-6-8-25(20-23)36-3/h6-14,19-20H,4-5,15-18H2,1-3H3,(H2,30,31,35)