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

Systemtic Name: (3R)-6-chloranyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: (3R)-6-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]chromane-3-carboxamide CAS Name: (3R)-6-chloro-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: (3R)-6-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: (3R)-6-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]chroman-3-carboxamide Formula: C21H25ClN3O2+ MolecularWeight: 386.8951

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3CC4=C(C=CC(=C4)Cl)OC3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)[C@@H]3CC4=C(C=CC(=C4)Cl)OC3

InChI

InChI=1S/C21H24ClN3O2/c1-24-8-10-25(11-9-24)19-5-3-18(4-6-19)23-21(26)16-12-15-13-17(22)2-7-20(15)27-14-16/h2-7,13,16H,8-12,14H2,1H3,(H,23,26)/p+1/t16-/m1/s1