4-[[(3-fluoranyl-4-methyl-phenyl)amino]methyl]-3-oxidanyl-benzo[c]chromen-6-one hydrochloride

Systemtic Name: 4-[[(3-fluoranyl-4-methyl-phenyl)amino]methyl]-3-oxidanyl-benzo[c]chromen-6-one hydrochloride Openeye Name: 4-[(3-fluoro-4-methyl-anilino)methyl]-3-hydroxy-benzo[c]chromen-6-one hydrochloride CAS Name: 4-[(3-fluoro-4-methylanilino)methyl]-3-hydroxy-6-benzo[c][1]benzopyranone hydrochloride IUPAC Name: 4-[(3-fluoro-4-methylanilino)methyl]-3-hydroxybenzo[c]chromen-6-one hydrochloride Traditional Name: 4-[(3-fluoro-4-methyl-anilino)methyl]-3-hydroxy-benzo[c]chromen-6-one hydrochloride Formula: C21H17ClFNO3 MolecularWeight: 385.815983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=C(C=CC3=C2OC(=O)C4=CC=CC=C34)O)F.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=C(C=CC3=C2OC(=O)C4=CC=CC=C34)O)F.Cl

InChI

InChI=1S/C21H16FNO3.ClH/c1-12-6-7-13(10-18(12)22)23-11-17-19(24)9-8-15-14-4-2-3-5-16(14)21(25)26-20(15)17;/h2-10,23-24H,11H2,1H3;1H