(4-ethenylpiperidin-1-yl) 7-ethoxy-4-[(4-ethylphenyl)-methyl-amino]-8-methyl-quinazoline-6-carboxylate

Systemtic Name: (4-ethenylpiperidin-1-yl) 7-ethoxy-4-[(4-ethylphenyl)-methyl-amino]-8-methyl-quinazoline-6-carboxylate Openeye Name: (4-vinyl-1-piperidyl) 7-ethoxy-4-(4-ethyl-N-methyl-anilino)-8-methyl-quinazoline-6-carboxylate CAS Name: 7-ethoxy-4-(4-ethyl-N-methylanilino)-8-methyl-6-quinazolinecarboxylic acid (4-ethenyl-1-piperidinyl) ester IUPAC Name: (4-ethenylpiperidin-1-yl) 7-ethoxy-4-(4-ethyl-N-methylanilino)-8-methylquinazoline-6-carboxylate Traditional Name: 7-ethoxy-4-(4-ethyl-N-methyl-anilino)-8-methyl-quinazoline-6-carboxylic acid (4-vinylpiperidino) ester Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C)C2=NC=NC3=C(C(=C(C=C32)C(=O)ON4CCC(CC4)C=C)OCC)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C)C2=NC=NC3=C(C(=C(C=C32)C(=O)ON4CCC(CC4)C=C)OCC)C

InChI

InChI=1S/C28H34N4O3/c1-6-20-9-11-22(12-10-20)31(5)27-23-17-24(26(34-8-3)19(4)25(23)29-18-30-27)28(33)35-32-15-13-21(7-2)14-16-32/h7,9-12,17-18,21H,2,6,8,13-16H2,1,3-5H3