tert-butyl 2-[3-[1-(3-azanylpropyl)-6-phenylmethoxy-indol-3-yl]-2-oxidanylidene-quinoxalin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[3-[1-(3-azanylpropyl)-6-phenylmethoxy-indol-3-yl]-2-oxidanylidene-quinoxalin-1-yl]ethanoate Openeye Name: tert-butyl 2-[3-[1-(3-aminopropyl)-6-benzyloxy-indol-3-yl]-2-oxo-quinoxalin-1-yl]acetate CAS Name: 2-[3-[1-(3-aminopropyl)-6-phenylmethoxy-3-indolyl]-2-oxo-1-quinoxalinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[1-(3-aminopropyl)-6-phenylmethoxyindol-3-yl]-2-oxoquinoxalin-1-yl]acetate Traditional Name: 2-[3-[1-(3-aminopropyl)-6-benzoxy-indol-3-yl]-2-keto-quinoxalin-1-yl]acetic acid tert-butyl ester Formula: C32H34N4O4 MolecularWeight: 538.63676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C2=CC=CC=C2N=C(C1=O)C3=CN(C4=C3C=CC(=C4)OCC5=CC=CC=C5)CCCN

Isomeric SMILES

CC(C)(C)OC(=O)CN1C2=CC=CC=C2N=C(C1=O)C3=CN(C4=C3C=CC(=C4)OCC5=CC=CC=C5)CCCN

InChI

InChI=1S/C32H34N4O4/c1-32(2,3)40-29(37)20-36-27-13-8-7-12-26(27)34-30(31(36)38)25-19-35(17-9-16-33)28-18-23(14-15-24(25)28)39-21-22-10-5-4-6-11-22/h4-8,10-15,18-19H,9,16-17,20-21,33H2,1-3H3