4-[2-(3-azanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]phenol; ethane

Systemtic Name: 4-[2-(3-azanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]phenol; ethane Openeye Name: 4-[2-(3-amino-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]phenol; ethane CAS Name: 4-[2-(3-amino-4-methoxyphenyl)-1,3-benzoxazol-5-yl]phenol; ethane IUPAC Name: 4-[2-(3-amino-4-methoxyphenyl)-1,3-benzoxazol-5-yl]phenol; ethane Traditional Name: 4-[2-(3-amino-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]phenol; ethane Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC.COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)O)N

Isomeric SMILES

CC.COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)O)N

InChI

InChI=1S/C20H16N2O3.C2H6/c1-24-18-8-5-14(10-16(18)21)20-22-17-11-13(4-9-19(17)25-20)12-2-6-15(23)7-3-12;1-2/h2-11,23H,21H2,1H3;1-2H3