[5-[(E)-but-1-enyl]-7-ethoxy-4-[(4-ethylphenyl)-methyl-amino]-8-methyl-quinazolin-6-yl] 4-ethenylpiperidine-1-carboxylate

Systemtic Name: [5-[(E)-but-1-enyl]-7-ethoxy-4-[(4-ethylphenyl)-methyl-amino]-8-methyl-quinazolin-6-yl] 4-ethenylpiperidine-1-carboxylate Openeye Name: [5-[(E)-but-1-enyl]-7-ethoxy-4-(4-ethyl-N-methyl-anilino)-8-methyl-quinazolin-6-yl] 4-vinylpiperidine-1-carboxylate CAS Name: 4-ethenyl-1-piperidinecarboxylic acid [5-[(E)-but-1-enyl]-7-ethoxy-4-(4-ethyl-N-methylanilino)-8-methyl-6-quinazolinyl] ester IUPAC Name: [5-[(E)-but-1-enyl]-7-ethoxy-4-(4-ethyl-N-methylanilino)-8-methylquinazolin-6-yl] 4-ethenylpiperidine-1-carboxylate Traditional Name: 4-vinylpiperidine-1-carboxylic acid [5-[(E)-but-1-enyl]-7-ethoxy-4-(4-ethyl-N-methyl-anilino)-8-methyl-quinazolin-6-yl] ester Formula: C32H40N4O3 MolecularWeight: 528.685

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1=C2C(=C(C(=C1OC(=O)N3CCC(CC3)C=C)OCC)C)N=CN=C2N(C)C4=CC=C(C=C4)CC

Isomeric SMILES

CC/C=C/C1=C2C(=C(C(=C1OC(=O)N3CCC(CC3)C=C)OCC)C)N=CN=C2N(C)C4=CC=C(C=C4)CC

InChI

InChI=1S/C32H40N4O3/c1-7-11-12-26-27-28(33-21-34-31(27)35(6)25-15-13-23(8-2)14-16-25)22(5)29(38-10-4)30(26)39-32(37)36-19-17-24(9-3)18-20-36/h9,11-16,21,24H,3,7-8,10,17-20H2,1-2,4-6H3/b12-11+