methyl 2-[1-[(6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[(6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-[(6,7-dimethoxy-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[6,7-dimethoxy-4-(1-pyrrolidinyl)-2-quinazolinyl]methyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[(6,7-dimethoxy-4-pyrrolidin-1-ylquinazolin-2-yl)methyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[(6,7-dimethoxy-4-pyrrolidino-quinazolin-2-yl)methyl]-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C22H29N5O5 MolecularWeight: 443.49616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)CN3CCNC(=O)C3CC(=O)OC)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)CN3CCNC(=O)C3CC(=O)OC)N4CCCC4)OC

InChI

InChI=1S/C22H29N5O5/c1-30-17-10-14-15(11-18(17)31-2)24-19(25-21(14)26-7-4-5-8-26)13-27-9-6-23-22(29)16(27)12-20(28)32-3/h10-11,16H,4-9,12-13H2,1-3H3,(H,23,29)