1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(6-methoxy-2-phenyl-quinazolin-4-yl)oxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(6-methoxy-2-phenyl-quinazolin-4-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-(6-methoxy-2-phenyl-quinazolin-4-yl)oxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[3,3-dimethyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]-4-[(6-methoxy-2-phenyl-4-quinazolinyl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(6-methoxy-2-phenylquinazolin-4-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-(6-methoxy-2-phenyl-quinazolin-4-yl)oxy-proline Formula: C31H38N4O7 MolecularWeight: 578.65602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=NC(=NC3=C2C=C(C=C3)OC)C4=CC=CC=C4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=NC(=NC3=C2C=C(C=C3)OC)C4=CC=CC=C4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C31H38N4O7/c1-30(2,3)24(33-29(39)42-31(4,5)6)27(36)35-17-20(16-23(35)28(37)38)41-26-21-15-19(40-7)13-14-22(21)32-25(34-26)18-11-9-8-10-12-18/h8-15,20,23-24H,16-17H2,1-7H3,(H,33,39)(H,37,38)