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

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-(oxan-4-ylmethyl)-4-oxidanylidene-8-(1-phenylethyl)cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-methyl-4-oxo-8-(1-phenylethyl)-6-(tetrahydropyran-4-ylmethyl)cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-(4-oxanylmethyl)-4-oxo-8-(1-phenylethyl)-3-cinnolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-methyl-6-(oxan-4-ylmethyl)-4-oxo-8-(1-phenylethyl)cinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-1-methyl-8-(1-phenylethyl)-6-(tetrahydropyran-4-ylmethyl)cinnoline-3-carboxamide Formula: C31H32ClN3O3 MolecularWeight: 530.05708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C2=C3C(=CC(=C2)CC4CCOCC4)C(=O)C(=NN3C)C(=O)NCC5=CC=C(C=C5)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)C2=C3C(=CC(=C2)CC4CCOCC4)C(=O)C(=NN3C)C(=O)NCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C31H32ClN3O3/c1-20(24-6-4-3-5-7-24)26-17-23(16-21-12-14-38-15-13-21)18-27-29(26)35(2)34-28(30(27)36)31(37)33-19-22-8-10-25(32)11-9-22/h3-11,17-18,20-21H,12-16,19H2,1-2H3,(H,33,37)