phenyl 2-[2-azanyl-6-[4-[cycloheptyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: phenyl 2-[2-azanyl-6-[4-[cycloheptyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate Openeye Name: phenyl 2-[2-amino-6-[4-[cycloheptyl(methyl)amino]-4-oxo-butoxy]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-amino-6-[4-[cycloheptyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetic acid phenyl ester IUPAC Name: phenyl 2-[2-amino-6-[4-[cycloheptyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-amino-6-[4-[cycloheptyl(methyl)amino]-4-keto-butoxy]-4H-quinazolin-3-yl]acetic acid phenyl ester Formula: C28H36N4O4 MolecularWeight: 492.60984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCCC1)C(=O)CCCOC2=CC3=C(C=C2)N=C(N(C3)CC(=O)OC4=CC=CC=C4)N

Isomeric SMILES

CN(C1CCCCCC1)C(=O)CCCOC2=CC3=C(C=C2)N=C(N(C3)CC(=O)OC4=CC=CC=C4)N

InChI

InChI=1S/C28H36N4O4/c1-31(22-10-5-2-3-6-11-22)26(33)14-9-17-35-24-15-16-25-21(18-24)19-32(28(29)30-25)20-27(34)36-23-12-7-4-8-13-23/h4,7-8,12-13,15-16,18,22H,2-3,5-6,9-11,14,17,19-20H2,1H3,(H2,29,30)