(4R,7S)-6-azanylidene-7-(3-hydroxyphenyl)-3-methyl-4-phenyl-5,7-dihydro-4H-1,2-benzoxazole-5-carbonitrile

Systemtic Name: (4R,7S)-6-azanylidene-7-(3-hydroxyphenyl)-3-methyl-4-phenyl-5,7-dihydro-4H-1,2-benzoxazole-5-carbonitrile Openeye Name: (4R,7S)-7-(3-hydroxyphenyl)-6-imino-3-methyl-4-phenyl-5,7-dihydro-4H-1,2-benzoxazole-5-carbonitrile CAS Name: (4R,7S)-7-(3-hydroxyphenyl)-6-imino-3-methyl-4-phenyl-5,7-dihydro-4H-1,2-benzoxazole-5-carbonitrile IUPAC Name: (4R,7S)-7-(3-hydroxyphenyl)-6-imino-3-methyl-4-phenyl-5,7-dihydro-4H-1,2-benzoxazole-5-carbonitrile Traditional Name: (4R,7S)-7-(3-hydroxyphenyl)-6-imino-3-methyl-4-phenyl-5,7-dihydro-4H-indoxazene-5-carbonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=NOC2=C1[C@H](C(C(=N)[C@@H]2C3=CC(=CC=C3)O)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/h2-10,16,18-19,23,25H,1H3/t16?,18-,19-/m0/s1