2-[7-butoxy-4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]prop-2-enoate; N-methylmethanamine

Systemtic Name: 2-[7-butoxy-4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]prop-2-enoate; N-methylmethanamine Openeye Name: 2-[7-butoxy-4-(4-phenoxyanilino)quinazolin-6-yl]prop-2-enoate; N-methylmethanamine CAS Name: 2-[7-butoxy-4-(4-phenoxyanilino)-6-quinazolinyl]-2-propenoate; N-methylmethanamine IUPAC Name: 2-[7-butoxy-4-(4-phenoxyanilino)quinazolin-6-yl]prop-2-enoate; N-methylmethanamine Traditional Name: 2-[7-butoxy-4-(4-phenoxyanilino)quinazolin-6-yl]acrylate; dimethylamine Formula: C29H31N4O4- MolecularWeight: 499.58084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=C)C(=O)[O-].CNC

Isomeric SMILES

CCCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=C)C(=O)[O-].CNC

InChI

InChI=1S/C27H25N3O4.C2H7N/c1-3-4-14-33-25-16-24-23(15-22(25)18(2)27(31)32)26(29-17-28-24)30-19-10-12-21(13-11-19)34-20-8-6-5-7-9-20;1-3-2/h5-13,15-17H,2-4,14H2,1H3,(H,31,32)(H,28,29,30);3H,1-2H3/p-1