ethyl 2-[[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]carbamoylamino]ethanoate

Systemtic Name: ethyl 2-[[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]carbamoylamino]ethanoate Openeye Name: ethyl 2-[[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]carbamoylamino]acetate CAS Name: 2-[[oxo-[4-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]anilino]methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]carbamoylamino]acetate Traditional Name: 2-[[4-[4-(9H-xanthene-9-carbonyl)piperazino]phenyl]carbamoylamino]acetic acid ethyl ester Formula: C29H30N4O5 MolecularWeight: 514.5723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CCOC(=O)CNC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C29H30N4O5/c1-2-37-26(34)19-30-29(36)31-20-11-13-21(14-12-20)32-15-17-33(18-16-32)28(35)27-22-7-3-5-9-24(22)38-25-10-6-4-8-23(25)27/h3-14,27H,2,15-19H2,1H3,(H2,30,31,36)