7-methyl-10-[(1R)-1-phenylethyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one

Systemtic Name: 7-methyl-10-[(1R)-1-phenylethyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Openeye Name: 7-methyl-10-[(1R)-1-phenylethyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one CAS Name: 7-methyl-10-[(1R)-1-phenylethyl]-10,11-dihydro-9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-10-ium-5-one IUPAC Name: 7-methyl-10-[(1R)-1-phenylethyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Traditional Name: 7-methyl-10-[(1R)-1-phenylethyl]-10,11-dihydro-9H-isochromeno[4,3-g][1,3]benzoxazin-10-ium-5-one Formula: C24H22NO3+ MolecularWeight: 372.43638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC3=C1OC[NH+](C3)C(C)C4=CC=CC=C4)C5=CC=CC=C5C(=O)O2

Isomeric SMILES

CC1=C2C(=CC3=C1OC[NH+](C3)[C@H](C)C4=CC=CC=C4)C5=CC=CC=C5C(=O)O2

InChI

InChI=1S/C24H21NO3/c1-15-22-18(13-25(14-27-22)16(2)17-8-4-3-5-9-17)12-21-19-10-6-7-11-20(19)24(26)28-23(15)21/h3-12,16H,13-14H2,1-2H3/p+1/t16-/m1/s1