2-[4-[3-[4-[(3-methoxy-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[3-[4-[(3-methoxy-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[3-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]piperazin-1-yl]ethanol CAS Name: 2-[4-[3-[4-(3-methoxy-4-phenoxyanilino)-6-quinazolinyl]prop-2-ynyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[3-[4-(3-methoxy-4-phenoxyanilino)quinazolin-6-yl]prop-2-ynyl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[3-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]piperazino]ethanol Formula: C30H31N5O3 MolecularWeight: 509.59884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN4CCN(CC4)CCO)OC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN4CCN(CC4)CCO)OC5=CC=CC=C5

InChI

InChI=1S/C30H31N5O3/c1-37-29-21-24(10-12-28(29)38-25-7-3-2-4-8-25)33-30-26-20-23(9-11-27(26)31-22-32-30)6-5-13-34-14-16-35(17-15-34)18-19-36/h2-4,7-12,20-22,36H,13-19H2,1H3,(H,31,32,33)