ethyl 4-[2-[(4-chloranylquinolin-2-yl)carbonylamino]-5-methoxy-5-oxidanylidene-pentanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-chloranylquinolin-2-yl)carbonylamino]-5-methoxy-5-oxidanylidene-pentanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(4-chloroquinoline-2-carbonyl)amino]-5-methoxy-5-oxo-pentanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[[(4-chloro-2-quinolinyl)-oxomethyl]amino]-5-methoxy-1,5-dioxopentyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-chloroquinoline-2-carbonyl)amino]-5-methoxy-5-oxopentanoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(4-chloroquinoline-2-carbonyl)amino]-5-keto-5-methoxy-pentanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H27ClN4O6 MolecularWeight: 490.93668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)OC)NC(=O)C2=NC3=CC=CC=C3C(=C2)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)OC)NC(=O)C2=NC3=CC=CC=C3C(=C2)Cl

InChI

InChI=1S/C23H27ClN4O6/c1-3-34-23(32)28-12-10-27(11-13-28)22(31)18(8-9-20(29)33-2)26-21(30)19-14-16(24)15-6-4-5-7-17(15)25-19/h4-7,14,18H,3,8-13H2,1-2H3,(H,26,30)