ethyl 2-[[2-(3-azanylpiperidin-1-yl)-6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl]methyl]benzoate

Systemtic Name: ethyl 2-[[2-(3-azanylpiperidin-1-yl)-6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl]methyl]benzoate Openeye Name: ethyl 2-[[2-(3-amino-1-piperidyl)-6,7-dimethoxy-4-oxo-quinazolin-3-yl]methyl]benzoate CAS Name: 2-[[2-(3-amino-1-piperidinyl)-6,7-dimethoxy-4-oxo-3-quinazolinyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-aminopiperidin-1-yl)-6,7-dimethoxy-4-oxoquinazolin-3-yl]methyl]benzoate Traditional Name: 2-[[2-(3-aminopiperidino)-4-keto-6,7-dimethoxy-quinazolin-3-yl]methyl]benzoic acid ethyl ester Formula: C25H30N4O5 MolecularWeight: 466.5295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1CN2C(=O)C3=CC(=C(C=C3N=C2N4CCCC(C4)N)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1CN2C(=O)C3=CC(=C(C=C3N=C2N4CCCC(C4)N)OC)OC

InChI

InChI=1S/C25H30N4O5/c1-4-34-24(31)18-10-6-5-8-16(18)14-29-23(30)19-12-21(32-2)22(33-3)13-20(19)27-25(29)28-11-7-9-17(26)15-28/h5-6,8,10,12-13,17H,4,7,9,11,14-15,26H2,1-3H3