4-(3-bromanyl-2-ethyl-phenyl)-5-(cyclopropylamino)-2-naphthalen-1-yl-furan-3-one

Systemtic Name: 4-(3-bromanyl-2-ethyl-phenyl)-5-(cyclopropylamino)-2-naphthalen-1-yl-furan-3-one Openeye Name: 4-(3-bromo-2-ethyl-phenyl)-5-(cyclopropylamino)-2-(1-naphthyl)furan-3-one CAS Name: 4-(3-bromo-2-ethylphenyl)-5-(cyclopropylamino)-2-(1-naphthalenyl)-3-furanone IUPAC Name: 4-(3-bromo-2-ethylphenyl)-5-(cyclopropylamino)-2-naphthalen-1-ylfuran-3-one Traditional Name: 4-(3-bromo-2-ethyl-phenyl)-5-(cyclopropylamino)-2-(1-naphthyl)furan-3-one Formula: C25H22BrNO2 MolecularWeight: 448.35168

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1Br)C2=C(OC(C2=O)C3=CC=CC4=CC=CC=C43)NC5CC5

Isomeric SMILES

CCC1=C(C=CC=C1Br)C2=C(OC(C2=O)C3=CC=CC4=CC=CC=C43)NC5CC5

InChI

InChI=1S/C25H22BrNO2/c1-2-17-19(10-6-12-21(17)26)22-23(28)24(29-25(22)27-16-13-14-16)20-11-5-8-15-7-3-4-9-18(15)20/h3-12,16,24,27H,2,13-14H2,1H3