tert-butyl 4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-[2-methyl-4-(phenylmethyl)piperazin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: tert-butyl 4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-[2-methyl-4-(phenylmethyl)piperazin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: tert-butyl 5-(4-benzyl-2-methyl-piperazin-1-yl)-4-[(4-methoxyquinoline-2-carbonyl)amino]-5-oxo-pentanoate CAS Name: 4-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-5-[2-methyl-4-(phenylmethyl)-1-piperazinyl]-5-oxopentanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-(4-benzyl-2-methylpiperazin-1-yl)-4-[(4-methoxyquinoline-2-carbonyl)amino]-5-oxopentanoate Traditional Name: 5-(4-benzyl-2-methyl-piperazino)-5-keto-4-[(4-methoxyquinoline-2-carbonyl)amino]valeric acid tert-butyl ester Formula: C32H40N4O5 MolecularWeight: 560.6838

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(CCC(=O)OC(C)(C)C)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC)CC4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(=O)C(CCC(=O)OC(C)(C)C)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC)CC4=CC=CC=C4

InChI

InChI=1S/C32H40N4O5/c1-22-20-35(21-23-11-7-6-8-12-23)17-18-36(22)31(39)26(15-16-29(37)41-32(2,3)4)34-30(38)27-19-28(40-5)24-13-9-10-14-25(24)33-27/h6-14,19,22,26H,15-18,20-21H2,1-5H3,(H,34,38)