2-azanyl-4-[2-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[2-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-[2-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-[2-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[2-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-[2-bromo-5-methoxy-4-(4-methylbenzyl)oxy-phenyl]-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C25H23BrN2O4 MolecularWeight: 495.36512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C(=C2)Br)C3C(=C(OC4=C3C(=O)CCC4)N)C#N)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C(=C2)Br)C3C(=C(OC4=C3C(=O)CCC4)N)C#N)OC

InChI

InChI=1S/C25H23BrN2O4/c1-14-6-8-15(9-7-14)13-31-22-11-18(26)16(10-21(22)30-2)23-17(12-27)25(28)32-20-5-3-4-19(29)24(20)23/h6-11,23H,3-5,13,28H2,1-2H3