benzoic acid; 8-(hydroxymethyl)-2-propan-2-yloxy-pyrido[2,1-b]quinazolin-11-one

Systemtic Name: benzoic acid; 8-(hydroxymethyl)-2-propan-2-yloxy-pyrido[2,1-b]quinazolin-11-one Openeye Name: benzoic acid; 8-(hydroxymethyl)-2-isopropoxy-pyrido[2,1-b]quinazolin-11-one CAS Name: benzoic acid; 8-(hydroxymethyl)-2-propan-2-yloxy-11-pyrido[2,1-b]quinazolinone IUPAC Name: benzoic acid; 8-(hydroxymethyl)-2-propan-2-yloxypyrido[2,1-b]quinazolin-11-one Traditional Name: benzoic acid; 2-isopropoxy-8-methylol-pyrido[2,1-b]quinazolin-11-one Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2=C(C=C1)N=C3C=CC(=CN3C2=O)CO.C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(C)OC1=CC2=C(C=C1)N=C3C=CC(=CN3C2=O)CO.C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C16H16N2O3.C7H6O2/c1-10(2)21-12-4-5-14-13(7-12)16(20)18-8-11(9-19)3-6-15(18)17-14;8-7(9)6-4-2-1-3-5-6/h3-8,10,19H,9H2,1-2H3;1-5H,(H,8,9)