6-chloranyl-3-phenethyl-3,4-dihydro-2H-pyrido[3,2-h][1,3]benzoxazine-3,10-diium

Systemtic Name: 6-chloranyl-3-phenethyl-3,4-dihydro-2H-pyrido[3,2-h][1,3]benzoxazine-3,10-diium Openeye Name: 6-chloro-3-phenethyl-3,4-dihydro-2H-pyrido[3,2-h][1,3]benzoxazine-3,10-diium CAS Name: 6-chloro-3-phenethyl-3,4-dihydro-2H-pyrido[3,2-h][1,3]benzoxazine-3,10-diium IUPAC Name: 6-chloro-3-phenethyl-3,4-dihydro-2H-pyrido[3,2-h][1,3]benzoxazine-3,10-diium Traditional Name: 6-chloro-3-phenethyl-3,4-dihydro-2H-pyrido[3,2-h][1,3]benzoxazine-3,10-diium Formula: C19H19ClN2O+2 MolecularWeight: 326.81996

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=C3C=CC=[NH+]C3=C2OC[NH+]1CCC4=CC=CC=C4)Cl

Isomeric SMILES

C1C2=CC(=C3C=CC=[NH+]C3=C2OC[NH+]1CCC4=CC=CC=C4)Cl

InChI

InChI=1S/C19H17ClN2O/c20-17-11-15-12-22(10-8-14-5-2-1-3-6-14)13-23-19(15)18-16(17)7-4-9-21-18/h1-7,9,11H,8,10,12-13H2/p+2