2-azanyl-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-4H-benzo[h]chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-4H-benzo[h]chromene-3-carbonitrile Openeye Name: 2-amino-4-(3-ethoxy-4-isobutoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile CAS Name: 2-amino-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-4H-benzo[h][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-4H-benzo[h]chromene-3-carbonitrile Traditional Name: 2-amino-4-(3-ethoxy-4-isobutoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OCC(C)C

InChI

InChI=1S/C26H26N2O3/c1-4-29-23-13-18(10-12-22(23)30-15-16(2)3)24-20-11-9-17-7-5-6-8-19(17)25(20)31-26(28)21(24)14-27/h5-13,16,24H,4,15,28H2,1-3H3