ethyl 4-(4-ethylpiperazin-1-yl)-3-[[4-(2-oxidanylidenechromen-3-yl)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[4-(2-oxidanylidenechromen-3-yl)phenyl]carbonylamino]benzoate Openeye Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[4-(2-oxochromen-3-yl)benzoyl]amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[oxo-[4-(2-oxo-1-benzopyran-3-yl)phenyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[[4-(2-oxochromen-3-yl)benzoyl]amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[[4-(2-ketochromen-3-yl)benzoyl]amino]benzoic acid ethyl ester Formula: C31H31N3O5 MolecularWeight: 525.59494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C31H31N3O5/c1-3-33-15-17-34(18-16-33)27-14-13-24(30(36)38-4-2)20-26(27)32-29(35)22-11-9-21(10-12-22)25-19-23-7-5-6-8-28(23)39-31(25)37/h5-14,19-20H,3-4,15-18H2,1-2H3,(H,32,35)