tert-butyl 4-[[4-[[methoxycarbonyl(phenyl)amino]carbamoyl]-2-phenyl-quinolin-3-yl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-[[methoxycarbonyl(phenyl)amino]carbamoyl]-2-phenyl-quinolin-3-yl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[4-[(N-methoxycarbonylanilino)carbamoyl]-2-phenyl-3-quinolyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(2-methoxycarbonyl-2-phenylhydrazinyl)-oxomethyl]-2-phenyl-3-quinolinyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-[(N-methoxycarbonylanilino)carbamoyl]-2-phenylquinolin-3-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[4-[(N-carbomethoxyanilino)carbamoyl]-2-phenyl-3-quinolyl]methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C34H37N5O5 MolecularWeight: 595.68808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=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(C)(C)OC(=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/C34H37N5O5/c1-34(2,3)44-32(41)38-21-19-37(20-22-38)23-27-29(31(40)36-39(33(42)43-4)25-15-9-6-10-16-25)26-17-11-12-18-28(26)35-30(27)24-13-7-5-8-14-24/h5-18H,19-23H2,1-4H3,(H,36,40)