2-[7-[4-(dimethylamino)butoxy]-4-[(4-phenylmethoxyphenyl)amino]quinazolin-6-yl]prop-2-enoate

Systemtic Name: 2-[7-[4-(dimethylamino)butoxy]-4-[(4-phenylmethoxyphenyl)amino]quinazolin-6-yl]prop-2-enoate Openeye Name: 2-[4-(4-benzyloxyanilino)-7-[4-(dimethylamino)butoxy]quinazolin-6-yl]prop-2-enoate CAS Name: 2-[7-[4-(dimethylamino)butoxy]-4-(4-phenylmethoxyanilino)-6-quinazolinyl]-2-propenoate IUPAC Name: 2-[7-[4-(dimethylamino)butoxy]-4-(4-phenylmethoxyanilino)quinazolin-6-yl]prop-2-enoate Traditional Name: 2-[4-(4-benzoxyanilino)-7-[4-(dimethylamino)butoxy]quinazolin-6-yl]acrylate Formula: C30H31N4O4- MolecularWeight: 511.59154

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=C)C(=O)[O-]

Isomeric SMILES

CN(C)CCCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=C)C(=O)[O-]

InChI

InChI=1S/C30H32N4O4/c1-21(30(35)36)25-17-26-27(18-28(25)37-16-8-7-15-34(2)3)31-20-32-29(26)33-23-11-13-24(14-12-23)38-19-22-9-5-4-6-10-22/h4-6,9-14,17-18,20H,1,7-8,15-16,19H2,2-3H3,(H,35,36)(H,31,32,33)/p-1