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2-[7-butoxy-4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]prop-2-enoic acid

2-[7-butoxy-4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]prop-2-enoic acid

Systemtic Name:2-[7-butoxy-4-[(4-phenoxyphenyl)amino]quinazolin-6-yl]prop-2-enoic acid
Openeye Name:2-[7-butoxy-4-(4-phenoxyanilino)quinazolin-6-yl]prop-2-enoic acid
CAS Name:2-[7-butoxy-4-(4-phenoxyanilino)-6-quinazolinyl]-2-propenoic acid
IUPAC Name:2-[7-butoxy-4-(4-phenoxyanilino)quinazolin-6-yl]prop-2-enoic acid
Traditional Name:2-[7-butoxy-4-(4-phenoxyanilino)quinazolin-6-yl]acrylic acid
Formula: C27H25N3O4
MolecularWeight: 455.5051
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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


Isomeric SMILES

CCCCOC1=C(C=C2C(=C1)N=CN=C2NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=C)C(=O)O


InChI

InChI=1S/C27H25N3O4/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/h5-13,15-17H,2-4,14H2,1H3,(H,31,32)(H,28,29,30)


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