N-(3-ethynyl-2-methyl-phenyl)-6,7-bis(2-methoxyethoxy)-8aH-quinazolin-1-amine

Systemtic Name: N-(3-ethynyl-2-methyl-phenyl)-6,7-bis(2-methoxyethoxy)-8aH-quinazolin-1-amine Openeye Name: N-(3-ethynyl-2-methyl-phenyl)-6,7-bis(2-methoxyethoxy)-8aH-quinazolin-1-amine CAS Name: N-(3-ethynyl-2-methylphenyl)-6,7-bis(2-methoxyethoxy)-8aH-quinazolin-1-amine IUPAC Name: N-(3-ethynyl-2-methylphenyl)-6,7-bis(2-methoxyethoxy)-8aH-quinazolin-1-amine Traditional Name: [6,7-bis(2-methoxyethoxy)-8aH-quinazolin-1-yl]-(3-ethynyl-2-methyl-phenyl)amine Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NN2C=NC=C3C2C=C(C(=C3)OCCOC)OCCOC)C#C

Isomeric SMILES

CC1=C(C=CC=C1NN2C=NC=C3C2C=C(C(=C3)OCCOC)OCCOC)C#C

InChI

InChI=1S/C23H27N3O4/c1-5-18-7-6-8-20(17(18)2)25-26-16-24-15-19-13-22(29-11-9-27-3)23(14-21(19)26)30-12-10-28-4/h1,6-8,13-16,21,25H,9-12H2,2-4H3