2-[(2-methoxy-2-oxidanylidene-ethyl)-(6-methyl-4-phenyl-quinazolin-2-yl)carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[(2-methoxy-2-oxidanylidene-ethyl)-(6-methyl-4-phenyl-quinazolin-2-yl)carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[(2-methoxy-2-oxo-ethyl)-(6-methyl-4-phenyl-quinazolin-2-yl)carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[(2-methoxy-2-oxoethyl)-(6-methyl-4-phenyl-2-quinazolinyl)amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[(2-methoxy-2-oxoethyl)-(6-methyl-4-phenylquinazolin-2-yl)carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[(2-keto-2-methoxy-ethyl)-(6-methyl-4-phenyl-quinazolin-2-yl)carbamoyl]cyclohexanecarboxylic acid Formula: C26H27N3O5 MolecularWeight: 461.50968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N(CC(=O)OC)C(=O)C4CCCCC4C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N(CC(=O)OC)C(=O)C4CCCCC4C(=O)O

InChI

InChI=1S/C26H27N3O5/c1-16-12-13-21-20(14-16)23(17-8-4-3-5-9-17)28-26(27-21)29(15-22(30)34-2)24(31)18-10-6-7-11-19(18)25(32)33/h3-5,8-9,12-14,18-19H,6-7,10-11,15H2,1-2H3,(H,32,33)