6-azanyl-7-(3-hydroxyphenyl)-3-methyl-4-phenyl-4,7-dihydro-1,2-benzoxazole-5-carbonitrile

Systemtic Name: 6-azanyl-7-(3-hydroxyphenyl)-3-methyl-4-phenyl-4,7-dihydro-1,2-benzoxazole-5-carbonitrile Openeye Name: 6-amino-7-(3-hydroxyphenyl)-3-methyl-4-phenyl-4,7-dihydro-1,2-benzoxazole-5-carbonitrile CAS Name: 6-amino-7-(3-hydroxyphenyl)-3-methyl-4-phenyl-4,7-dihydro-1,2-benzoxazole-5-carbonitrile IUPAC Name: 6-amino-7-(3-hydroxyphenyl)-3-methyl-4-phenyl-4,7-dihydro-1,2-benzoxazole-5-carbonitrile Traditional Name: 6-amino-7-(3-hydroxyphenyl)-3-methyl-4-phenyl-4,7-dihydroindoxazene-5-carbonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC2=C1C(C(=C(C2C3=CC(=CC=C3)O)N)C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=NOC2=C1C(C(=C(C2C3=CC(=CC=C3)O)N)C#N)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2/c1-12-17-18(13-6-3-2-4-7-13)16(11-22)20(23)19(21(17)26-24-12)14-8-5-9-15(25)10-14/h2-10,18-19,25H,23H2,1H3