N-[(4-chlorophenyl)methyl]-1-methyl-6-(oxan-4-ylmethyl)-4-oxidanylidene-8-(3-oxidanylpropyl)cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-(oxan-4-ylmethyl)-4-oxidanylidene-8-(3-oxidanylpropyl)cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxypropyl)-1-methyl-4-oxo-6-(tetrahydropyran-4-ylmethyl)cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxypropyl)-1-methyl-6-(4-oxanylmethyl)-4-oxo-3-cinnolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-(3-hydroxypropyl)-1-methyl-6-(oxan-4-ylmethyl)-4-oxocinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-(3-hydroxypropyl)-4-keto-1-methyl-6-(tetrahydropyran-4-ylmethyl)cinnoline-3-carboxamide Formula: C26H30ClN3O4 MolecularWeight: 483.9871

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl)CC4CCOCC4)CCCO

Isomeric SMILES

CN1C2=C(C=C(C=C2C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl)CC4CCOCC4)CCCO

InChI

InChI=1S/C26H30ClN3O4/c1-30-24-20(3-2-10-31)14-19(13-17-8-11-34-12-9-17)15-22(24)25(32)23(29-30)26(33)28-16-18-4-6-21(27)7-5-18/h4-7,14-15,17,31H,2-3,8-13,16H2,1H3,(H,28,33)