tert-butyl 3-[[1,4-bis(chloranyl)isoquinolin-7-yl]carbonylamino]propanoate

Systemtic Name: tert-butyl 3-[[1,4-bis(chloranyl)isoquinolin-7-yl]carbonylamino]propanoate Openeye Name: tert-butyl 3-[(1,4-dichloroisoquinoline-7-carbonyl)amino]propanoate CAS Name: 3-[[(1,4-dichloro-7-isoquinolinyl)-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(1,4-dichloroisoquinoline-7-carbonyl)amino]propanoate Traditional Name: 3-[(1,4-dichloroisoquinoline-7-carbonyl)amino]propionic acid tert-butyl ester Formula: C17H18Cl2N2O3 MolecularWeight: 369.24242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCNC(=O)C1=CC2=C(C=C1)C(=CN=C2Cl)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CCNC(=O)C1=CC2=C(C=C1)C(=CN=C2Cl)Cl

InChI

InChI=1S/C17H18Cl2N2O3/c1-17(2,3)24-14(22)6-7-20-16(23)10-4-5-11-12(8-10)15(19)21-9-13(11)18/h4-5,8-9H,6-7H2,1-3H3,(H,20,23)