3-phenyl-9-[(1S)-1-phenylethyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one

Systemtic Name: 3-phenyl-9-[(1S)-1-phenylethyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Openeye Name: 3-phenyl-9-[(1S)-1-phenylethyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one CAS Name: 3-phenyl-9-[(1S)-1-phenylethyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one IUPAC Name: 3-phenyl-9-[(1S)-1-phenylethyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Traditional Name: 3-phenyl-9-[(1S)-1-phenylethyl]-9,10-dihydro-8H-pyrano[2,3-f][1,3]benzoxazin-9-ium-4-one Formula: C25H22NO3+ MolecularWeight: 384.44708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH+]2CC3=C(C=CC4=C3OC=C(C4=O)C5=CC=CC=C5)OC2

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH+]2CC3=C(C=CC4=C3OC=C(C4=O)C5=CC=CC=C5)OC2

InChI

InChI=1S/C25H21NO3/c1-17(18-8-4-2-5-9-18)26-14-21-23(29-16-26)13-12-20-24(27)22(15-28-25(20)21)19-10-6-3-7-11-19/h2-13,15,17H,14,16H2,1H3/p+1/t17-/m0/s1