methyl N-[[3-[(4-ethanoylpiperazin-1-yl)methyl]-2-phenyl-quinolin-4-yl]carbonylamino]-N-phenyl-carbamate

Systemtic Name: methyl N-[[3-[(4-ethanoylpiperazin-1-yl)methyl]-2-phenyl-quinolin-4-yl]carbonylamino]-N-phenyl-carbamate Openeye Name: methyl N-[[3-[(4-acetylpiperazin-1-yl)methyl]-2-phenyl-quinoline-4-carbonyl]amino]-N-phenyl-carbamate CAS Name: N-[[[3-[(4-acetyl-1-piperazinyl)methyl]-2-phenyl-4-quinolinyl]-oxomethyl]amino]-N-phenylcarbamic acid methyl ester IUPAC Name: methyl N-[[3-[(4-acetylpiperazin-1-yl)methyl]-2-phenylquinoline-4-carbonyl]amino]-N-phenylcarbamate Traditional Name: N-[[3-[(4-acetylpiperazino)methyl]-2-phenyl-quinoline-4-carbonyl]amino]-N-phenyl-carbamic acid methyl ester Formula: C31H31N5O4 MolecularWeight: 537.60894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C4)C(=O)NN(C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C4)C(=O)NN(C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C31H31N5O4/c1-22(37)35-19-17-34(18-20-35)21-26-28(30(38)33-36(31(39)40-2)24-13-7-4-8-14-24)25-15-9-10-16-27(25)32-29(26)23-11-5-3-6-12-23/h3-16H,17-21H2,1-2H3,(H,33,38)