phenyl 2-methoxybenzo[b]acridin-5-ium-12-carboxylate

Systemtic Name: phenyl 2-methoxybenzo[b]acridin-5-ium-12-carboxylate Openeye Name: phenyl 2-methoxybenzo[b]acridin-5-ium-12-carboxylate CAS Name: 2-methoxy-12-benzo[b]acridin-5-iumcarboxylic acid phenyl ester IUPAC Name: phenyl 2-methoxybenzo[b]acridin-5-ium-12-carboxylate Traditional Name: 2-methoxybenz[b]acridin-5-ium-12-carboxylic acid phenyl ester Formula: C25H18NO3+ MolecularWeight: 380.41532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C3=CC4=CC=CC=C4C=C3[NH+]=C2C=C1)C(=O)OC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C3=CC4=CC=CC=C4C=C3[NH+]=C2C=C1)C(=O)OC5=CC=CC=C5

InChI

InChI=1S/C25H17NO3/c1-28-19-11-12-22-21(15-19)24(25(27)29-18-9-3-2-4-10-18)20-13-16-7-5-6-8-17(16)14-23(20)26-22/h2-15H,1H3/p+1