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

Systemtic Name: 2-azanyl-4-(3-methoxy-4-phenylmethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Openeye Name: 2-amino-4-(4-benzyloxy-3-methoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile CAS Name: 2-amino-4-(3-methoxy-4-phenylmethoxyphenyl)-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(3-methoxy-4-phenylmethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile Traditional Name: 2-amino-4-(4-benzoxy-3-methoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Formula: C28H22N2O3 MolecularWeight: 434.48588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OCC5=CC=CC=C5

InChI

InChI=1S/C28H22N2O3/c1-31-25-15-20(12-14-24(25)32-17-18-7-3-2-4-8-18)26-22-13-11-19-9-5-6-10-21(19)27(22)33-28(30)23(26)16-29/h2-15,26H,17,30H2,1H3