N-[7-butoxy-6-[(4-ethenylpiperidin-1-yl)amino]-5-pent-4-ynyl-8-prop-2-enyl-quinazolin-4-yl]-N-propyl-nitramide

Systemtic Name: N-[7-butoxy-6-[(4-ethenylpiperidin-1-yl)amino]-5-pent-4-ynyl-8-prop-2-enyl-quinazolin-4-yl]-N-propyl-nitramide Openeye Name: N-[8-allyl-7-butoxy-5-pent-4-ynyl-6-[(4-vinyl-1-piperidyl)amino]quinazolin-4-yl]-N-propyl-nitramide CAS Name: N-[7-butoxy-6-[(4-ethenyl-1-piperidinyl)amino]-5-pent-4-ynyl-8-prop-2-enyl-4-quinazolinyl]-N-propylnitramide IUPAC Name: N-[7-butoxy-6-[(4-ethenylpiperidin-1-yl)amino]-5-pent-4-ynyl-8-prop-2-enylquinazolin-4-yl]-N-propylnitramide Traditional Name: N-[8-allyl-7-butoxy-5-pent-4-ynyl-6-[(4-vinylpiperidino)amino]quinazolin-4-yl]-N-propyl-nitramide Formula: C30H42N6O3 MolecularWeight: 534.69288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C2C(=C1CC=C)N=CN=C2N(CCC)[N+](=O)[O-])CCCC#C)NN3CCC(CC3)C=C

Isomeric SMILES

CCCCOC1=C(C(=C2C(=C1CC=C)N=CN=C2N(CCC)[N+](=O)[O-])CCCC#C)NN3CCC(CC3)C=C

InChI

InChI=1S/C30H42N6O3/c1-6-11-13-15-24-26-27(31-22-32-30(26)35(18-9-4)36(37)38)25(14-8-3)29(39-21-12-7-2)28(24)33-34-19-16-23(10-5)17-20-34/h1,8,10,22-23,33H,3,5,7,9,11-21H2,2,4H3