4-methylpentyl 2-[2-azanyl-6-[4-(dihexylamino)-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: 4-methylpentyl 2-[2-azanyl-6-[4-(dihexylamino)-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate Openeye Name: isohexyl 2-[2-amino-6-[4-(dihexylamino)-4-oxo-butoxy]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-amino-6-[4-(dihexylamino)-4-oxobutoxy]-4H-quinazolin-3-yl]acetic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 2-[2-amino-6-[4-(dihexylamino)-4-oxobutoxy]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-amino-6-[4-(dihexylamino)-4-keto-butoxy]-4H-quinazolin-3-yl]acetic acid isohexyl ester Formula: C32H54N4O4 MolecularWeight: 558.79556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=O)CCCOC1=CC2=C(C=C1)N=C(N(C2)CC(=O)OCCCC(C)C)N

Isomeric SMILES

CCCCCCN(CCCCCC)C(=O)CCCOC1=CC2=C(C=C1)N=C(N(C2)CC(=O)OCCCC(C)C)N

InChI

InChI=1S/C32H54N4O4/c1-5-7-9-11-19-35(20-12-10-8-6-2)30(37)16-14-21-39-28-17-18-29-27(23-28)24-36(32(33)34-29)25-31(38)40-22-13-15-26(3)4/h17-18,23,26H,5-16,19-22,24-25H2,1-4H3,(H2,33,34)