1-[9-(4-aminophenyl)-10-methyl-acridin-10-ium-1-yl]-3-azanyl-propan-1-one chloride

Systemtic Name: 1-[9-(4-aminophenyl)-10-methyl-acridin-10-ium-1-yl]-3-azanyl-propan-1-one chloride Openeye Name: 3-amino-1-[9-(4-aminophenyl)-10-methyl-acridin-10-ium-1-yl]propan-1-one chloride CAS Name: 3-amino-1-[9-(4-aminophenyl)-10-methyl-1-acridin-10-iumyl]-1-propanone chloride IUPAC Name: 3-amino-1-[9-(4-aminophenyl)-10-methylacridin-10-ium-1-yl]propan-1-one chloride Traditional Name: 3-amino-1-[9-(4-aminophenyl)-10-methyl-acridin-10-ium-1-yl]propan-1-one chloride Formula: C23H22ClN3O MolecularWeight: 391.89328

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC=C(C2=C(C3=CC=CC=C31)C4=CC=C(C=C4)N)C(=O)CCN.[Cl-]

Isomeric SMILES

C[N+]1=C2C=CC=C(C2=C(C3=CC=CC=C31)C4=CC=C(C=C4)N)C(=O)CCN.[Cl-]

InChI

InChI=1S/C23H21N3O.ClH/c1-26-19-7-3-2-5-17(19)22(15-9-11-16(25)12-10-15)23-18(21(27)13-14-24)6-4-8-20(23)26;/h2-12,25H,13-14,24H2,1H3;1H