tert-butyl 4-[4-[[6-methoxy-8-(4-methylpiperazin-1-yl)-4-oxidanylidene-chromen-2-yl]carbonylamino]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[[6-methoxy-8-(4-methylpiperazin-1-yl)-4-oxidanylidene-chromen-2-yl]carbonylamino]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[[6-methoxy-8-(4-methylpiperazin-1-yl)-4-oxo-chromene-2-carbonyl]amino]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[[[6-methoxy-8-(4-methyl-1-piperazinyl)-4-oxo-1-benzopyran-2-yl]-oxomethyl]amino]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[[6-methoxy-8-(4-methylpiperazin-1-yl)-4-oxochromene-2-carbonyl]amino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[[4-keto-6-methoxy-8-(4-methylpiperazino)chromene-2-carbonyl]amino]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C31H39N5O6 MolecularWeight: 577.67126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=O)C4=CC(=CC(=C4O3)N5CCN(CC5)C)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=O)C4=CC(=CC(=C4O3)N5CCN(CC5)C)OC

InChI

InChI=1S/C31H39N5O6/c1-31(2,3)42-30(39)36-16-14-34(15-17-36)22-8-6-21(7-9-22)32-29(38)27-20-26(37)24-18-23(40-5)19-25(28(24)41-27)35-12-10-33(4)11-13-35/h6-9,18-20H,10-17H2,1-5H3,(H,32,38)