5-(2-oxidanylpropoxy)-2-phenyl-3-[(phenylmethyl)-propan-2-yl-amino]chromen-4-one

Systemtic Name: 5-(2-oxidanylpropoxy)-2-phenyl-3-[(phenylmethyl)-propan-2-yl-amino]chromen-4-one Openeye Name: 3-[benzyl(isopropyl)amino]-5-(2-hydroxypropoxy)-2-phenyl-chromen-4-one CAS Name: 5-(2-hydroxypropoxy)-2-phenyl-3-[(phenylmethyl)-propan-2-ylamino]-1-benzopyran-4-one IUPAC Name: 3-[benzyl(propan-2-yl)amino]-5-(2-hydroxypropoxy)-2-phenylchromen-4-one Traditional Name: 3-[benzyl(isopropyl)amino]-5-(2-hydroxypropoxy)-2-phenyl-chromone Formula: C28H29NO4 MolecularWeight: 443.53416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C2=C(OC3=C(C2=O)C(=CC=C3)OCC(C)O)C4=CC=CC=C4

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C2=C(OC3=C(C2=O)C(=CC=C3)OCC(C)O)C4=CC=CC=C4

InChI

InChI=1S/C28H29NO4/c1-19(2)29(17-21-11-6-4-7-12-21)26-27(31)25-23(32-18-20(3)30)15-10-16-24(25)33-28(26)22-13-8-5-9-14-22/h4-16,19-20,30H,17-18H2,1-3H3