ethyl 4-[[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate CAS Name: 4-[[oxo-[4-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]anilino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]carbamoylamino]benzoate Traditional Name: 4-[[4-[4-(9H-xanthene-9-carbonyl)piperazino]phenyl]carbamoylamino]benzoic acid ethyl ester Formula: C34H32N4O5 MolecularWeight: 576.64168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C34H32N4O5/c1-2-42-33(40)23-11-13-24(14-12-23)35-34(41)36-25-15-17-26(18-16-25)37-19-21-38(22-20-37)32(39)31-27-7-3-5-9-29(27)43-30-10-6-4-8-28(30)31/h3-18,31H,2,19-22H2,1H3,(H2,35,36,41)