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

Systemtic Name: [1-[3-[4-[(3-methoxy-4-phenoxy-phenyl)amino]quinazolin-6-yl]prop-2-ynyl]piperidin-4-yl]methanol Openeye Name: [1-[3-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]-4-piperidyl]methanol CAS Name: [1-[3-[4-(3-methoxy-4-phenoxyanilino)-6-quinazolinyl]prop-2-ynyl]-4-piperidinyl]methanol IUPAC Name: [1-[3-[4-(3-methoxy-4-phenoxyanilino)quinazolin-6-yl]prop-2-ynyl]piperidin-4-yl]methanol Traditional Name: [1-[3-[4-(3-methoxy-4-phenoxy-anilino)quinazolin-6-yl]prop-2-ynyl]-4-piperidyl]methanol Formula: C30H30N4O3 MolecularWeight: 494.5842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN4CCC(CC4)CO)OC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C#CCN4CCC(CC4)CO)OC5=CC=CC=C5

InChI

InChI=1S/C30H30N4O3/c1-36-29-19-24(10-12-28(29)37-25-7-3-2-4-8-25)33-30-26-18-22(9-11-27(26)31-21-32-30)6-5-15-34-16-13-23(20-35)14-17-34/h2-4,7-12,18-19,21,23,35H,13-17,20H2,1H3,(H,31,32,33)