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

Systemtic Name: 4-chloranyl-N-[2-(3-prop-2-enyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide Openeye Name: N-[2-(3-allyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]-4-chloro-benzamide CAS Name: 4-chloro-N-[2-(3-prop-2-enyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide IUPAC Name: 4-chloro-N-[2-(3-prop-2-enyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]benzamide Traditional Name: N-[2-(3-allyl-3,4-dihydro-2H-1,3-benzoxazin-3-ium-6-yl)ethyl]-4-chloro-benzamide Formula: C20H22ClN2O2+ MolecularWeight: 357.85388

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CC2=C(C=CC(=C2)CCNC(=O)C3=CC=C(C=C3)Cl)OC1

Isomeric SMILES

C=CC[NH+]1CC2=C(C=CC(=C2)CCNC(=O)C3=CC=C(C=C3)Cl)OC1

InChI

InChI=1S/C20H21ClN2O2/c1-2-11-23-13-17-12-15(3-8-19(17)25-14-23)9-10-22-20(24)16-4-6-18(21)7-5-16/h2-8,12H,1,9-11,13-14H2,(H,22,24)/p+1