4-(2-methoxy-10-methyl-7-phosphonooxy-acridin-10-ium-9-yl)carbonyloxy-3,5-dimethyl-benzoic acid

Systemtic Name: 4-(2-methoxy-10-methyl-7-phosphonooxy-acridin-10-ium-9-yl)carbonyloxy-3,5-dimethyl-benzoic acid Openeye Name: 4-(2-methoxy-10-methyl-7-phosphonooxy-acridin-10-ium-9-carbonyl)oxy-3,5-dimethyl-benzoic acid CAS Name: 4-[(2-methoxy-10-methyl-7-phosphonooxy-9-acridin-10-iumyl)-oxomethoxy]-3,5-dimethylbenzoic acid IUPAC Name: 4-(2-methoxy-10-methyl-7-phosphonooxyacridin-10-ium-9-carbonyl)oxy-3,5-dimethylbenzoic acid Traditional Name: 4-(2-methoxy-10-methyl-7-phosphonooxy-acridin-10-ium-9-carbonyl)oxy-3,5-dimethyl-benzoic acid Formula: C25H23NO9P+ MolecularWeight: 512.425181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=[N+](C4=C2C=C(C=C4)OP(=O)(O)O)C)OC)C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=[N+](C4=C2C=C(C=C4)OP(=O)(O)O)C)OC)C)C(=O)O

InChI

InChI=1S/C25H22NO9P/c1-13-9-15(24(27)28)10-14(2)23(13)34-25(29)22-18-11-16(33-4)5-7-20(18)26(3)21-8-6-17(12-19(21)22)35-36(30,31)32/h5-12H,1-4H3,(H2-,27,28,30,31,32)/p+1