N-[(4-chlorophenyl)methyl]-6-(morpholin-4-ylmethyl)-1-(oxan-4-yl)-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-6-(morpholin-4-ylmethyl)-1-(oxan-4-yl)-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-6-(morpholinomethyl)-4-oxo-1-tetrahydropyran-4-yl-quinoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-(4-morpholinylmethyl)-1-(4-oxanyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(morpholin-4-ylmethyl)-1-(oxan-4-yl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-6-(morpholinomethyl)-1-tetrahydropyran-4-yl-quinoline-3-carboxamide Formula: C27H30ClN3O4 MolecularWeight: 495.9978

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1N2C=C(C(=O)C3=C2C=CC(=C3)CN4CCOCC4)C(=O)NCC5=CC=C(C=C5)Cl

Isomeric SMILES

C1COCCC1N2C=C(C(=O)C3=C2C=CC(=C3)CN4CCOCC4)C(=O)NCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H30ClN3O4/c28-21-4-1-19(2-5-21)16-29-27(33)24-18-31(22-7-11-34-12-8-22)25-6-3-20(15-23(25)26(24)32)17-30-9-13-35-14-10-30/h1-6,15,18,22H,7-14,16-17H2,(H,29,33)