methyl 2-[3,6-bis(azanyl)anthracen-9-yl]benzoate hydrochloride

Systemtic Name: methyl 2-[3,6-bis(azanyl)anthracen-9-yl]benzoate hydrochloride Openeye Name: methyl 2-(3,6-diamino-9-anthryl)benzoate hydrochloride CAS Name: 2-(3,6-diamino-9-anthracenyl)benzoic acid methyl ester hydrochloride IUPAC Name: methyl 2-(3,6-diaminoanthracen-9-yl)benzoate hydrochloride Traditional Name: 2-(3,6-diamino-9-anthryl)benzoic acid methyl ester hydrochloride Formula: C22H19ClN2O2 MolecularWeight: 378.85146

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=C3C=CC(=CC3=CC4=C2C=CC(=C4)N)N.Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=C3C=CC(=CC3=CC4=C2C=CC(=C4)N)N.Cl

InChI

InChI=1S/C22H18N2O2.ClH/c1-26-22(25)20-5-3-2-4-19(20)21-17-8-6-15(23)11-13(17)10-14-12-16(24)7-9-18(14)21;/h2-12H,23-24H2,1H3;1H