4-chloranyl-N-[2-(3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide

Systemtic Name: 4-chloranyl-N-[2-(3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide Openeye Name: 4-chloro-N-[2-(3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide CAS Name: 4-chloro-N-[2-(3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide IUPAC Name: 4-chloro-N-[2-(3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide Traditional Name: 4-chloro-N-[2-(3-cyclohexyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide Formula: C23H28ClN2O2+ MolecularWeight: 399.93362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CC3=C(C=CC(=C3)CCNC(=O)C4=CC=C(C=C4)Cl)OC2

Isomeric SMILES

C1CCC(CC1)[NH+]2CC3=C(C=CC(=C3)CCNC(=O)C4=CC=C(C=C4)Cl)OC2

InChI

InChI=1S/C23H27ClN2O2/c24-20-9-7-18(8-10-20)23(27)25-13-12-17-6-11-22-19(14-17)15-26(16-28-22)21-4-2-1-3-5-21/h6-11,14,21H,1-5,12-13,15-16H2,(H,25,27)/p+1