4-[[4-[6-methoxy-7-(1-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazin-1-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[4-[6-methoxy-7-(1-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazin-1-yl]carbonylamino]benzoic acid Openeye Name: 4-[[4-[6-methoxy-7-(1-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazine-1-carbonyl]amino]benzoic acid CAS Name: 4-[[[4-[6-methoxy-7-[1-(3-pyrrolidinyl)propoxy]-4-quinazolinyl]-1-piperazinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[4-[6-methoxy-7-(1-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazine-1-carbonyl]amino]benzoic acid Traditional Name: 4-[[4-[6-methoxy-7-(1-pyrrolidin-3-ylpropoxy)quinazolin-4-yl]piperazine-1-carbonyl]amino]benzoic acid Formula: C28H34N6O5 MolecularWeight: 534.60676

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCNC1)OC2=C(C=C3C(=C2)N=CN=C3N4CCN(CC4)C(=O)NC5=CC=C(C=C5)C(=O)O)OC

Isomeric SMILES

CCC(C1CCNC1)OC2=C(C=C3C(=C2)N=CN=C3N4CCN(CC4)C(=O)NC5=CC=C(C=C5)C(=O)O)OC

InChI

InChI=1S/C28H34N6O5/c1-3-23(19-8-9-29-16-19)39-25-15-22-21(14-24(25)38-2)26(31-17-30-22)33-10-12-34(13-11-33)28(37)32-20-6-4-18(5-7-20)27(35)36/h4-7,14-15,17,19,23,29H,3,8-13,16H2,1-2H3,(H,32,37)(H,35,36)