phenyl 2-[2-azanyl-8-[7-[methyl-(phenylmethyl)amino]-7-oxidanylidene-heptoxy]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: phenyl 2-[2-azanyl-8-[7-[methyl-(phenylmethyl)amino]-7-oxidanylidene-heptoxy]-4H-quinazolin-3-yl]ethanoate Openeye Name: phenyl 2-[2-amino-8-[7-[benzyl(methyl)amino]-7-oxo-heptoxy]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-amino-8-[7-[methyl-(phenylmethyl)amino]-7-oxoheptoxy]-4H-quinazolin-3-yl]acetic acid phenyl ester IUPAC Name: phenyl 2-[2-amino-8-[7-[benzyl(methyl)amino]-7-oxoheptoxy]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-amino-8-[7-[benzyl(methyl)amino]-7-keto-heptoxy]-4H-quinazolin-3-yl]acetic acid phenyl ester Formula: C31H36N4O4 MolecularWeight: 528.64194

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CCCCCCOC2=CC=CC3=C2N=C(N(C3)CC(=O)OC4=CC=CC=C4)N

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CCCCCCOC2=CC=CC3=C2N=C(N(C3)CC(=O)OC4=CC=CC=C4)N

InChI

InChI=1S/C31H36N4O4/c1-34(21-24-13-6-4-7-14-24)28(36)19-10-2-3-11-20-38-27-18-12-15-25-22-35(31(32)33-30(25)27)23-29(37)39-26-16-8-5-9-17-26/h4-9,12-18H,2-3,10-11,19-23H2,1H3,(H2,32,33)