2-azanyl-4-[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-4H-benzo[h]chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-bromanyl-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-4H-benzo[h]chromene-3-carbonitrile Openeye Name: 2-amino-4-[3-bromo-5-methoxy-4-(p-tolylmethoxy)phenyl]-4H-benzo[h]chromene-3-carbonitrile CAS Name: 2-amino-4-[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-bromo-5-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-4H-benzo[h]chromene-3-carbonitrile Traditional Name: 2-amino-4-[3-bromo-5-methoxy-4-(4-methylbenzyl)oxy-phenyl]-4H-benzo[h]chromene-3-carbonitrile Formula: C29H23BrN2O3 MolecularWeight: 527.40852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C3C4=C(C5=CC=CC=C5C=C4)OC(=C3C#N)N)OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2Br)C3C4=C(C5=CC=CC=C5C=C4)OC(=C3C#N)N)OC

InChI

InChI=1S/C29H23BrN2O3/c1-17-7-9-18(10-8-17)16-34-28-24(30)13-20(14-25(28)33-2)26-22-12-11-19-5-3-4-6-21(19)27(22)35-29(32)23(26)15-31/h3-14,26H,16,32H2,1-2H3