methyl 2-azanyl-4-[5-[(3-bromanylphenoxy)methyl]furan-2-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate

Systemtic Name: methyl 2-azanyl-4-[5-[(3-bromanylphenoxy)methyl]furan-2-yl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate Openeye Name: methyl 2-amino-4-[5-[(3-bromophenoxy)methyl]-2-furyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate CAS Name: 2-amino-4-[5-[(3-bromophenoxy)methyl]-2-furanyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-[5-[(3-bromophenoxy)methyl]furan-2-yl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate Traditional Name: 2-amino-4-[5-[(3-bromophenoxy)methyl]-2-furyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carboxylic acid methyl ester Formula: C24H24BrNO6 MolecularWeight: 502.35446

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=C(O3)COC4=CC(=CC=C4)Br)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=C(O3)COC4=CC(=CC=C4)Br)C(=O)C1)C

InChI

InChI=1S/C24H24BrNO6/c1-24(2)10-16(27)19-18(11-24)32-22(26)21(23(28)29-3)20(19)17-8-7-15(31-17)12-30-14-6-4-5-13(25)9-14/h4-9,20H,10-12,26H2,1-3H3