6-chloranyl-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: 6-chloranyl-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: 6-chloro-N-[4-(3-oxopiperazin-1-yl)phenyl]chromane-3-carboxamide CAS Name: 6-chloro-N-[4-(3-oxo-1-piperazinyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-chloro-N-[4-(3-oxopiperazin-1-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: 6-chloro-N-[4-(3-ketopiperazino)phenyl]chroman-3-carboxamide Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3CC4=C(C=CC(=C4)Cl)OC3

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)NC(=O)C3CC4=C(C=CC(=C4)Cl)OC3

InChI

InChI=1S/C20H20ClN3O3/c21-15-1-6-18-13(10-15)9-14(12-27-18)20(26)23-16-2-4-17(5-3-16)24-8-7-22-19(25)11-24/h1-6,10,14H,7-9,11-12H2,(H,22,25)(H,23,26)