(4R)-2,7-bis(azanyl)-4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4H-chromene-3-carbonitrile

Systemtic Name: (4R)-2,7-bis(azanyl)-4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4H-chromene-3-carbonitrile Openeye Name: (4R)-2,7-diamino-4-(3-ethoxy-4-isopentyloxy-phenyl)-4H-chromene-3-carbonitrile CAS Name: (4R)-2,7-diamino-4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4H-1-benzopyran-3-carbonitrile IUPAC Name: (4R)-2,7-diamino-4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-4H-chromene-3-carbonitrile Traditional Name: (4R)-2,7-diamino-4-(3-ethoxy-4-isoamoxy-phenyl)-4H-chromene-3-carbonitrile Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C3=C(C=C(C=C3)N)OC(=C2C#N)N)OCCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@@H]2C3=C(C=C(C=C3)N)OC(=C2C#N)N)OCCC(C)C

InChI

InChI=1S/C23H27N3O3/c1-4-27-21-11-15(5-8-19(21)28-10-9-14(2)3)22-17-7-6-16(25)12-20(17)29-23(26)18(22)13-24/h5-8,11-12,14,22H,4,9-10,25-26H2,1-3H3/t22-/m1/s1